SCHEMBL5261395

SCHEMBL5261395

O=C(O)c1nc2cnccc2c(=O)[nH]1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 17/20 0.57
▸ KDM5A P29375 1/20 0.55
▸ MAPT P10636 2/20 0.52
▸ TOP2A P11388 1/20 0.47
▸ TOP2B Q02880 1/20 0.47
▸ PARP1 P09874 1/20 0.47
▸ CSNK2A1 P68400 1/20 0.47
▸ KDM4A O75164 2/20 0.46
▸ KDM5C P41229 2/20 0.46
▸ KDM4B O94953 1/20 0.46
▸ KDM5B Q9UGL1 1/20 0.46
▸ KDM3A Q9Y4C1 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ KDM4D Q6B0I6 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
SCHEMBL8196669 0.86 KDM4C (0.56) KDM4CKDM5AMAPTTOP2ATOP2B
SCHEMBL4936991 0.80 TOP2A (0.58) MAPTTOP2ATOP2BPARP1KDM4E
SCHEMBL29965486 0.80 TOP2A (0.58) MAPTTOP2ATOP2BPARP1KDM4E
SCHEMBL4927788 0.79 KDM4C (0.60) KDM4CKDM5AMAPTKDM5BKDM4E
SCHEMBL20339526 0.75 PARP1 (0.70) KDM4CKDM5AMAPTPARP1
SCHEMBL8199597 0.75 KDM4C (0.59) KDM4CKDM5AMAPTKDM5B
SCHEMBL2814618 0.75 PIN1 (0.54) KDM4E
SCHEMBL25190918 0.75 QTRT1 (0.61) KDM4CKDM5AMAPTKDM4AKDM5C
SCHEMBL8279823 0.75 KDM4C (0.68) KDM4CKDM5AMAPTPARP1KDM4A
SCHEMBL16908336 0.75 KDM4C (0.59) KDM4CKDM5AMAPTKDM4AKDM5C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7713966-B2 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2010-05-11 — — US disclosed
US-7713966-B2 Heterobicyclic metalloprotease inhibitors ALANTOS PHARMACEUTICALS HOLDING, INC. (US) 2010-05-11 — — US disclosed
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors GEGE CHRISTIAN 2008-10-23 — — US disclosed
US-20080261968-A1 Heterobicyclic metalloprotease inhibitors GEGE CHRISTIAN 2008-10-23 — — US disclosed
EP-1740551-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR Takeda Pharmaceutical Company Limited (JP) 2007-01-10 — — EP disclosed
WO-2005105760-A1 HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-11-10 — — WO 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 (1 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-20080261968-A1 Heterobicyclic metalloprotease inhibitors MMP13, TIMP3, MMP3 KDM4C 1011/4885KDM5A 921/4885MAPT 4248/4885

“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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