SCHEMBL970017

SCHEMBL970017

CC(C)(C)c1ccc(OCCOCCO)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
CYP3A4 P08684 2/20 0.56
APP P05067 5/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
USP2 O75604 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
MAPK1 P28482 1/20 0.53
CASP1 P29466 1/20 0.53
SLCO1B3 Q9NPD5 1/20 0.53
SLCO1B1 Q9Y6L6 1/20 0.53
KDM4E B2RXH2 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
HRH3 Q9Y5N1 5/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL970571 1.00 SMN1; SMN2 (0.56) SMN1; SMN2CYP3A4APPMEN1KMT2A
SCHEMBL12391998 1.00 SMN1; SMN2 (0.56) SMN1; SMN2CYP3A4APPMEN1KMT2A
SCHEMBL466186 0.89 SMN1; SMN2 (0.56) SMN1; SMN2CYP3A4APPMEN1KMT2A
SCHEMBL19912050 0.89 CYP3A4 (0.56) SMN1; SMN2CYP3A4APPMEN1KMT2A
SCHEMBL5473974 0.89 SMN1; SMN2 (0.56) SMN1; SMN2CYP3A4APPMEN1KMT2A
SCHEMBL5468192 0.89 SMN1; SMN2 (0.56) SMN1; SMN2CYP3A4APPMEN1KMT2A
SCHEMBL5457352 0.89 SMN1; SMN2 (0.56) SMN1; SMN2CYP3A4APPMEN1KMT2A
SCHEMBL5459507 0.89 SMN1; SMN2 (0.56) SMN1; SMN2CYP3A4APPMEN1KMT2A
SCHEMBL5462324 0.89 SMN1; SMN2 (0.56) SMN1; SMN2CYP3A4APPMEN1KMT2A
SCHEMBL270793 0.89 SMN1; SMN2 (0.68) SMN1; SMN2CYP3A4APPMEN1KMT2A

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220220103-A1 CYCLIN-DEPENDENT KINASE INHIBITORS SPV THERAPEUTICS INC. 2022-07-14 US disclosed
US-20180147289-A9 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2018-05-31 US disclosed
US-20180147289-A9 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2018-05-31 US disclosed
US-20180133316-A9 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2018-05-17 US disclosed
US-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers SYNTARGA BV (NL) 2017-11-23 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-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-9629924-B2 Conjugates of CC-1065 analogs and bifunctional linkers SYNTARGA BV (NL) 2017-04-25 US disclosed
US-9629924-B2 Conjugates of CC-1065 analogs and bifunctional linkers SYNTARGA BV (NL) 2017-04-25 US disclosed
EP-2259137-B1 METHOD FOR PRODUCING A OF LITHOGRAPHIC PRINTING PLATE FUJIFILM CORP (JP) 2016-08-31 EP disclosed
US-8889868-B2 CC-1065 analogs and their conjugates SYNTARGA BV (NL) 2014-11-18 US disclosed
US-20130224227-A1 NOVEL CONJUGATES OF CC-1065 ANALOGS AND BIFUNCTIONAL LINKERS BYONDIS B.V. (NL) 2013-08-29 US disclosed
US-20110207767-A1 Novel cc-1065 Analogs and Their Conjugates BYONDIS B.V. (NL) 2011-08-25 US disclosed
US-20110168044-A1 METHOD OF PREPARING LITHOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2011-07-14 US disclosed
US-20110020751-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR AND PRODUCTION PROCESS OF LITHOGRAPHIC PRINTING PLATE USING THE PRECURSOR FUJIFILM CORPORATION (JP) 2011-01-27 US disclosed
EP-2259137-A1 ORIGINAL PLATE FOR LITHOGRAPHIC PRINTING PLATE, AND METHOD FOR PRODUCTION OF LITHOGRAPHIC PRINTING PLATE USING THE SAME FUJIFILM Corporation (JP) 2010-12-08 EP disclosed
US-4255152-A USING A DISPERSE DYE, WATER, AND AN ADDUCT OF ETHYLENE, PROPYLENE, OR STYRENE OXIDE AND A CYCLIC-SUBSTITUTED PHENOL; LEVELLING CIBA-GEIGY CORPORATION (US) 1981-03-10 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 (7 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-20170274090-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L SMN1; SMN2 645/4885CYP3A4 4379/4885APP 4829/4885
US-20170333567-A1 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L SMN1; SMN2 645/4885CYP3A4 4379/4885APP 4829/4885
US-20110207767-A1 Novel cc-1065 Analogs and Their Conjugates PCNA, CDC5L, TOP1 SMN1; SMN2 590/4885CYP3A4 3774/4885APP 4837/4885
US-20180133316-A9 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L SMN1; SMN2 645/4885CYP3A4 4379/4885APP 4829/4885
US-20220220103-A1 CYCLIN-DEPENDENT KINASE INHIBITORS CDK2, CDK1, CCNK SMN1; SMN2 3671/4885CYP3A4 4088/4885APP 4674/4885
US-20180147289-A9 Novel Conjugates of CC-1065 Analogs and Bifunctional Linkers PCNA, DCLRE1A, CDC5L SMN1; SMN2 645/4885CYP3A4 4379/4885APP 4829/4885
US-20130224227-A1 NOVEL CONJUGATES OF CC-1065 ANALOGS AND BIFUNCTIONAL LINKERS PCNA, DCLRE1A, CDC5L SMN1; SMN2 645/4885CYP3A4 4379/4885APP 4829/4885

“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.