SCHEMBL16075696

SCHEMBL16075696

COCCn1cnc(-c2cc(C(=O)OC)ccn2)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 9/20 0.58
▸ KDM5A P29375 8/20 0.58
▸ KDM2B Q8NHM5 5/20 0.57
▸ JMJD6 Q6NYC1 1/20 0.57
▸ KDM4C Q9H3R0 9/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ KDM6B O15054 1/20 0.57
▸ KDM5C P41229 1/20 0.57
▸ KDM2A Q9Y2K7 1/20 0.57
▸ KDM3A Q9Y4C1 1/20 0.57
▸ KDM4A O75164 4/20 0.53

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
SCHEMBL16033892 0.89 KDM5A (0.60) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL16075699 0.89 KDM5A (0.74) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL16033441 0.87 KDM5A (0.53) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL16032737 0.84 KDM2B (0.74) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL16075703 0.84 KDM4C (0.52) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL16034331 0.80 KDM5B (0.77) KDM5BKDM5AKDM2BJMJD6KDM4C
SCHEMBL29894587 0.79 KDM4E (0.86) KDM5BJMJD6KDM4CKDM4EKDM6B
SCHEMBL70279 0.79 KDM4E (0.86) KDM5BJMJD6KDM4CKDM4EKDM6B
SCHEMBL16034354 0.78 KDM4C (0.59) KDM5BKDM5AKDM2BJMJD6KDM4C
Hydrochloric Acid SCHEMBL6504834 0.78 KDM4E (0.83) KDM5BJMJD6KDM4CKDM4EKDM6B

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-9963441-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-05-08 — — US disclosed
US-20170334879-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2017-11-23 — — US disclosed
US-9701657-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2017-07-11 — — US disclosed
US-20170066739-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE PHARMACEUTICALS INC (US) 2017-03-09 — — US disclosed
US-9527829-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2016-12-27 — — US disclosed
US-20160122314-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC 2016-05-05 — — US disclosed
US-20160113914-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2016-04-28 — — US disclosed
US-9133166-B2 Histone demethylase inhibitors Quanticel Pharmaceuticals, Inc. (US) 2015-09-15 — — US disclosed
US-20140275084-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-18 — — 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 (5 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-20170066739-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM5B 10/4885KDM5A 8/4885KDM2B 19/4885
US-20170334879-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM5B 10/4885KDM5A 8/4885KDM2B 19/4885
US-20140275084-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM5B 10/4885KDM5A 8/4885KDM2B 19/4885
US-20160122314-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM5B 10/4885KDM5A 8/4885KDM2B 19/4885
US-20160113914-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM5B 10/4885KDM5A 8/4885KDM2B 19/4885

“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.

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