SCHEMBL16095231

SCHEMBL16095231

CC(C)C(c1ccccc1)c1nc(-c2cc(-c3nn[nH]n3)ccn2)c[nH]1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 16/20 0.58
▸ KDM5A P29375 5/20 0.58
▸ KDM5B Q9UGL1 3/20 0.58
▸ KDM2B Q8NHM5 2/20 0.44
▸ CAMK2D Q13557 1/20 0.42
▸ PHF8 Q9UPP1 1/20 0.41
▸ GP6 Q9HCN6 1/20 0.40
▸ KDM4A O75164 1/20 0.39

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
SCHEMBL16095245 0.77 KDM4C (0.53) KDM4CKDM5AKDM5BCAMK2DKDM4A
SCHEMBL16032889 0.74 KDM4C (1.00) KDM4CKDM5AKDM5BKDM2BPHF8
SCHEMBL20978820 0.70 KDM4C (0.66) KDM4CKDM5AKDM5BKDM2BKDM4A
SCHEMBL16095348 0.69 KDM4C (0.63) KDM4CKDM5AKDM5BKDM2BPHF8
SCHEMBL16034893 0.69 KDM4C (1.00) KDM4CKDM5AKDM5BKDM2BPHF8
SCHEMBL16095912 0.69 KDM4C (0.61) KDM4CKDM5AKDM5BKDM2BPHF8
SCHEMBL16095232 0.69 KDM4C (0.48) KDM4CKDM5AKDM5BKDM2B
SCHEMBL16095409 0.68 KDM4C (0.65) KDM4CKDM5AKDM5BKDM2BPHF8
SCHEMBL16095032 0.66 KDM4C (0.65) KDM4CKDM5AKDM5BKDM2BPHF8
SCHEMBL16095265 0.66 KDM4C (0.62) KDM4CKDM5AKDM5BKDM2BKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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