SCHEMBL16095137

SCHEMBL16095137

Cc1nc(-c2cc(-c3nn[nH]n3)ccn2)c(-c2ccc(F)cc2OCc2ccccc2)[nH]1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 11/20 0.69
▸ KDM5A P29375 1/20 0.51
▸ KDM2B Q8NHM5 1/20 0.48
▸ CCNT1 O60563 1/20 0.40
▸ CCNA2 P20248 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ CDK9 P50750 1/20 0.40
▸ CCNA1 P78396 1/20 0.40

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
SCHEMBL16102665 0.86 KDM4C (0.68) KDM4CKDM5AKDM2B
SCHEMBL16095130 0.86 KDM4C (0.69) KDM4CKDM5AKDM2B
SCHEMBL16095526 0.86 KDM4C (0.69) KDM4CKDM2B
SCHEMBL16033749 0.82 KDM4C (1.00) KDM4CKDM5AKDM2B
SCHEMBL16095268 0.80 KDM4C (0.45) KDM4CCCNT1CCNA2CDK2CDK9
SCHEMBL16095141 0.76 KDM4C (0.61) KDM4CKDM5AKDM2B
SCHEMBL16095042 0.72 KDM4C (0.67) KDM4CKDM5AKDM2B
SCHEMBL16033615 0.71 KDM4C (1.00) KDM4CKDM5AKDM2B
SCHEMBL16095534 0.69 KDM4C (0.62) KDM4CKDM2B
SCHEMBL17693323 0.68 KDM4C (0.74) KDM4CKDM5AKDM2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2969007-B1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2019-05-08 — — EP disclosed
EP-2969007-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals Inc (US) 2016-01-20 — — EP disclosed
WO-2014151945-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-25 — — WO disclosed
Send feedback