SCHEMBL16095245

SCHEMBL16095245

CC(C)C(c1ccccc1)c1nc(-c2cc(C(=O)O)ccn2)c[nH]1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 10/20 0.53
▸ KDM4A O75164 8/20 0.53
▸ KDM5B Q9UGL1 9/20 0.52
▸ KDM5A P29375 4/20 0.52
▸ KDM5C P41229 8/20 0.49
▸ KDM2A Q9Y2K7 4/20 0.49
▸ KDM3A Q9Y4C1 4/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ KDM6B O15054 3/20 0.49
▸ KDM4B O94953 4/20 0.43
▸ JMJD6 Q6NYC1 1/20 0.42
▸ P4HA1 P13674 1/20 0.42
▸ LDHA P00338 1/20 0.40
▸ LDHB P07195 1/20 0.40
▸ CAMK2D Q13557 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
SCHEMBL16103133 0.81 KDM4C (0.56) KDM4CKDM4AKDM5BKDM5AKDM5C
SCHEMBL16095231 0.77 KDM4C (0.58) KDM4CKDM4AKDM5BKDM5ACAMK2D
SCHEMBL4921443 0.71 KDM4C (0.75) KDM4CKDM4AKDM5BKDM5AKDM5C
SCHEMBL16096062 0.71 KDM4C (0.54) KDM4CKDM4AKDM5BKDM5AKDM5C
SCHEMBL16094928 0.71 KDM5C (0.55) KDM4CKDM4AKDM5BKDM5AKDM5C
SCHEMBL29407015 0.70 KDM4C (0.78) KDM4CKDM4AKDM5BKDM5AKDM5C
SCHEMBL70700 0.70 KDM4C (0.78) KDM4CKDM4AKDM5BKDM5AKDM5C
Dipyridyl SCHEMBL8358045 0.69 KDM4C (0.96) KDM4CKDM4AKDM5BKDM5AKDM5C
SCHEMBL16033641 0.69 KDM4C (1.00) KDM4CKDM4AKDM5BKDM5AKDM5C
SCHEMBL16032741 0.68 KDM5B (1.00) KDM4CKDM4AKDM5BKDM5AKDM5C

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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