SCHEMBL18878413

SCHEMBL18878413

CC(C)CC(C)CCCC(C)(C)O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
ALDH1A1 P00352 1/20 0.41
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.35
PTPN1 P18031 2/20 0.33
PTPN2 P17706 1/20 0.33
CDC25B P30305 1/20 0.33
KCNH3 Q9ULD8 1/20 0.32
KISS1R Q969F8 1/20 0.31
BLM P54132 1/20 0.30

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
SCHEMBL16357610 0.85 ALDH1A1 (0.50) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL8344885 0.84 ALDH1A1 (0.39) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL17274593 0.83 MEN1 (0.39) MEN1KMT2ACYP3A4ALOX15LMNA
SCHEMBL28088410 0.81 MEN1 (0.62) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL81885 0.79 ALDH1A1 (0.50) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL6897656 0.79 MEN1 (0.43) MEN1KMT2ACYP3A4ALOX15
SCHEMBL997419 0.79 ALDH1A1 (0.35) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL14867329 0.79 ALDH1A1 (0.35) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL14763880 0.79 ALDH1A1 (0.35) MEN1KMT2ACYP3A4ALOX15ALDH1A1
SCHEMBL10070256 0.78 ALDH1A1 (0.43) MEN1KMT2ACYP3A4ALOX15ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236082-B2 EZH2 inhibitors and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-02-01 US disclosed
US-20190192532-A1 COMBINATION THERAPY OF BROMODOMAIN INHIBITORS AND CHECKPOINT BLOCKADE PETER MACCALLUM CANCER INSTITUTE (AU) 2019-06-27 US disclosed
US-20190000860-A1 USE OF COMPOSITIONS MODULATING CHROMATIN STRUCTURE FOR GRAFT VERSUS HOST DISEASE (GVHD) DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-01-03 US disclosed
US-20180169097-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-06-21 US disclosed
US-9951074-B2 Dihydropteridinone derivatives and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-04-24 US disclosed
US-20170145023-A1 DIAZEPANE DERIVATIVES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-05-25 US disclosed
US-20170145023-A1 DIAZEPANE DERIVATIVES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-05-25 US disclosed
US-20170145013-A1 DIHYDROPTERIDINONE DERIVATIVES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-05-25 US disclosed
US-20170145013-A1 DIHYDROPTERIDINONE DERIVATIVES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-05-25 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 (6 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-20190000860-A1 USE OF COMPOSITIONS MODULATING CHROMATIN STRUCTURE FOR GRAFT VERSUS HOST DISEASE (GVHD) BCL6, BCL6B, EZH2 MEN1 3905/4885KMT2A 47/4885CYP3A4 4206/4885
US-20180169097-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS CHUK, BCOR, MYC MEN1 2398/4885KMT2A 233/4885CYP3A4 4863/4885
US-20190192532-A1 COMBINATION THERAPY OF BROMODOMAIN INHIBITORS AND CHECKPOINT BLOCKADE BRD4, BRD3, BRPF3 MEN1 3328/4885KMT2A 56/4885CYP3A4 4346/4885
US-20170145013-A1 DIHYDROPTERIDINONE DERIVATIVES AND USES THEREOF BRDT, BRD4, BRD3 MEN1 2473/4885KMT2A 1790/4885CYP3A4 4229/4885
US-11236082-B2 EZH2 inhibitors and uses thereof EZH2, EZH1, BMI1 MEN1 1860/4885KMT2A 19/4885CYP3A4 4417/4885
US-20170145023-A1 DIAZEPANE DERIVATIVES AND USES THEREOF BRDT, BRD4, BAZ2A MEN1 2439/4885KMT2A 962/4885CYP3A4 3930/4885

“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.