SCHEMBL16034316

SCHEMBL16034316

CCCn1cnc(-c2ccccn2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 7/20 0.57
▸ KDM5B Q9UGL1 7/20 0.57
▸ KDM4E B2RXH2 3/20 0.47
▸ LMNA P02545 3/20 0.47
▸ CCR1 P32246 3/20 0.47
▸ CCR5 P51681 3/20 0.47
▸ CCR8 P51685 3/20 0.47
▸ CYP1A2 P05177 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ METAP1 P53582 1/20 0.47
▸ BLM P54132 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ DOHH Q9BU89 1/20 0.47
▸ P4HTM Q9NXG6 1/20 0.47
▸ KDM4C Q9H3R0 7/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ CYP2E1 P05181 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2A6 P11509 1/20 0.43

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
SCHEMBL7101565 0.83 KDM4E (0.47) KDM5AKDM5BKDM4ELMNACCR1
SCHEMBL18579661 0.83 KDM5A (0.60) KDM5AKDM5BKDM4ELMNACCR1
SCHEMBL7990801 0.79 CYP2E1 (0.53) KDM5AKDM5BCYP2C9CYP2C19CYP2E1
SCHEMBL18579812 0.79 KDM4C (0.67) KDM5AKDM5BKDM4CKDM4AKDM2B
SCHEMBL18579509 0.78 KDM2B (0.62) KDM5AKDM5BKDM4ELMNACCR1
SCHEMBL19628763 0.78 KDM5B (0.62) KDM5AKDM5BKDM4CKDM4AKDM2B
SCHEMBL12075252 0.77 KDM4E (0.56) KDM5AKDM5BKDM4ELMNACCR1
SCHEMBL18579569 0.76 KDM5B (0.62) KDM5AKDM5BKDM4CKDM4ASMN1; SMN2
SCHEMBL18579762 0.76 KDM5A (0.67) KDM5AKDM5BKDM4EKDM4CKDM4A
SCHEMBL18579672 0.76 KDM4C (0.67) KDM5AKDM5BKDM4CKDM4AKDM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10273222-B2 Histone demethylase inhibitors CELGENE QUANTSCEL RESEARCH, INC. (US) 2019-04-30 — — 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-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-10273222-B2 Histone demethylase inhibitors KDM1B, KDM1A, KDM3B KDM5A 8/4885KDM5B 10/4885KDM4E 16/4885
US-20170334879-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM5A 8/4885KDM5B 10/4885KDM4E 16/4885
US-20140275084-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM5A 8/4885KDM5B 10/4885KDM4E 16/4885
US-20160122314-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM5A 8/4885KDM5B 10/4885KDM4E 16/4885
US-20160113914-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM3B KDM5A 8/4885KDM5B 10/4885KDM4E 16/4885

“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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