SCHEMBL1753750

SCHEMBL1753750

CC(C)Nc1ccc(COC(=O)C(C)(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.43
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
MAPT P10636 2/20 0.40
KDM4E B2RXH2 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ELANE P08246 1/20 0.39
PRKCA P17252 1/20 0.38
PRKCD Q05655 1/20 0.38
NPR3 P17342 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
LMNA P02545 3/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
THRB P10828 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19901428 0.92 MEN1 (0.54) ROCK2MEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL1753582 0.92 MEN1 (0.54) ROCK2MEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL23318499 0.88 ROCK2 (0.42) ROCK2MEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL19201796 0.85 ROCK2 (0.43) ROCK2MEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL26549546 0.84 ROCK2 (0.40) ROCK2MEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL27305897 0.83 ELANE (0.52) MEN1KMT2AL3MBTL1SMN1; SMN2MAPT
SCHEMBL18792766 0.82 ELANE (0.46) ROCK2MEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL11946728 0.82 ALDH1A1 (0.55) MEN1KMT2AL3MBTL1SMN1; SMN2RXFP1
SCHEMBL9917266 0.82 RXFP1 (0.44) ROCK2MEN1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL24541057 0.81 MEN1 (0.43) ROCK2MEN1KMT2AL3MBTL1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11779649-B2 Antibodies to PMEL17 and conjugates thereof NOVARTIS AG (CH) 2023-10-10 US disclosed
US-20230144211-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES BYONDIS B.V. (NL) 2023-05-11 US disclosed
US-20230027495-A1 METHODS OF TREATING CANCER WITH A COMBINATION OF AN ANTI-PD-1 ANTIBODY AND AN ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATE GENMAB A/S (DK) 2023-01-26 US disclosed
US-20220387485-A1 METHODS OF TREATING CANCER WITH A COMBINATION OF A PLATINUM-BASED AGENT AND AN ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATE GENMAB A/S (DK) 2022-12-08 US disclosed
US-20220133901-A1 ROR1 ANTIBODY IMMUNOCONJUGATES VelosBio Inc. (US) 2022-05-05 US disclosed
US-20220119392-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES BYONDIS B.V. (NL) 2022-04-21 US disclosed
US-20210228731-A1 ANTIBODY DRUG CONJUGATES FOR ABLATING HEMATOPOIETIC STEM CELLS NOVARTIS INSTITUTE FOR FUNCTIONAL GENOMICS, INC. 2021-07-29 US disclosed
US-20210228676-A1 Combination Therapy With LIV1-ADC and PD-1 Antagonist MERCK SHARP & DOHME B.V. (NL) 2021-07-29 US disclosed
US-11052155-B2 Conjugates of CC-1065 analogs and bifunctional linkers SYNTARGA BV (NL) 2021-07-06 US disclosed
US-20210177987-A1 ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATES AND THEIR USE IN THE TREATMENT OF CANCER GENMAB A/S (DK) 2021-06-17 US disclosed
US-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2017-11-23 US disclosed
US-9815784-B2 CC-1065 analogs and their conjugates SYNTARGA B.V. (NL) 2017-11-14 US disclosed
US-20170274090-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2017-09-28 US disclosed
US-20170252458-A1 ERIBULIN-BASED ANTIBODY-DRUG CONJUGATES AND METHODS OF USE MORPHOTEK, INC. 2017-09-07 US disclosed
US-9629924-B2 Conjugates of CC-1065 analogs and bifunctional linkers SYNTARGA BV (NL) 2017-04-25 US disclosed
US-9585970-B2 Site-specific labeling methods and molecules produced thereby NOVARTIS AG (CH) 2017-03-07 US disclosed
US-8940784-B2 Water-soluble CC-1065 analogs and their conjugates SYNTARGA B.V. (NL) 2015-01-27 US disclosed
US-8158590-B2 Triazole-containing releasable linkers, conjugates thereof, and methods of preparation SYNTARGA B.V. (NL) 2012-04-17 US disclosed
US-20090318668-A1 Water-Soluble CC-1065 Analogs and Their Conjugates Georg-August-Universität Göttingen Stiftung öffentlichen Rechts (ohne Bereich Humanmedizin) (DE) 2009-12-24 US disclosed
US-20080311136-A1 Triazole-Containing Releasable Linkers, Conjugates Thereof, and Methods of Preparation BYONDIS B.V. (NL) 2008-12-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (15 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210228676-A1 Combination Therapy With LIV1-ADC and PD-1 Antagonist PDCD1, CD274, PDCD1LG2 ROCK2 2663/4885MEN1 708/4885KMT2A 978/4885
US-20210177987-A1 ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATES AND THEIR USE IN THE TREATMENT OF CANCER F3, F13B, PGF ROCK2 1097/4885MEN1 1369/4885KMT2A 1914/4885
US-20170274090-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L ROCK2 4010/4885MEN1 1237/4885KMT2A 1026/4885
US-20090318668-A1 Water-Soluble CC-1065 Analogs and Their Conjugates PCNA, DCK, BAD ROCK2 3469/4885MEN1 2080/4885KMT2A 1501/4885
US-11779649-B2 Antibodies to PMEL17 and conjugates thereof GNA15, GNA11, EEA1 ROCK2 3141/4885MEN1 670/4885KMT2A 864/4885
US-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L ROCK2 4010/4885MEN1 1237/4885KMT2A 1026/4885
US-20210228731-A1 ANTIBODY DRUG CONJUGATES FOR ABLATING HEMATOPOIETIC STEM CELLS BCR, ABL1, CD47 ROCK2 2530/4885MEN1 2274/4885KMT2A 21/4885
US-20230144211-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES DHFR, FOLR1, MTHFD2 ROCK2 4155/4885MEN1 1545/4885KMT2A 1224/4885
US-20230027495-A1 METHODS OF TREATING CANCER WITH A COMBINATION OF AN ANTI-PD-1 ANTIBODY AND AN ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATE CD274, PDCD1, PDCD1LG2 ROCK2 1022/4885MEN1 1303/4885KMT2A 1075/4885
US-20080311136-A1 Triazole-Containing Releasable Linkers, Conjugates Thereof, and Methods of Preparation PAICS, CD44, TRIM33 ROCK2 3058/4885MEN1 581/4885KMT2A 2312/4885
US-11052155-B2 Conjugates of CC-1065 analogs and bifunctional linkers PCNA, DCLRE1A, CDC5L ROCK2 3857/4885MEN1 1247/4885KMT2A 1003/4885
US-20170252458-A1 ERIBULIN-BASED ANTIBODY-DRUG CONJUGATES AND METHODS OF USE FOLR1, FOLR2, TUBB1 ROCK2 1748/4885MEN1 3472/4885KMT2A 4423/4885
US-20220133901-A1 ROR1 ANTIBODY IMMUNOCONJUGATES RORA, RORB, RORC ROCK2 1089/4885MEN1 1857/4885KMT2A 1538/4885
US-20220119392-A1 ANTIFOLATE LINKER-DRUGS AND ANTIBODY-DRUG CONJUGATES DHFR, FOLR1, MTHFD2 ROCK2 4155/4885MEN1 1545/4885KMT2A 1224/4885
US-20220387485-A1 METHODS OF TREATING CANCER WITH A COMBINATION OF A PLATINUM-BASED AGENT AND AN ANTI-TISSUE FACTOR ANTIBODY-DRUG CONJUGATE F3, TFPI, ADAMTS13 ROCK2 1875/4885MEN1 1777/4885KMT2A 1811/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.