SCHEMBL16095331

SCHEMBL16095331

CN(CCc1nc(-c2cc(C(=O)O)ccn2)c[nH]1)Cc1ccc(F)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM2B Q8NHM5 3/20 0.55
▸ KDM5B Q9UGL1 10/20 0.48
▸ KDM5A P29375 8/20 0.48
▸ KDM4C Q9H3R0 6/20 0.47
▸ KDM4A O75164 5/20 0.47
▸ PPARA Q07869 1/20 0.40
▸ KDM5C P41229 4/20 0.38
▸ KDM6B O15054 2/20 0.38
▸ KDM2A Q9Y2K7 2/20 0.38
▸ KDM3A Q9Y4C1 2/20 0.38
▸ KDM4B O94953 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38

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
SCHEMBL16095275 0.90 KDM4C (0.49) KDM2BKDM5BKDM5AKDM4CKDM4A
SCHEMBL16095045 0.89 KDM5B (0.48) KDM2BKDM5BKDM5AKDM4CKDM4A
SCHEMBL16094674 0.86 KDM4C (0.48) KDM2BKDM5BKDM5AKDM4CKDM4A
SCHEMBL16104961 0.82 KDM5B (0.55) KDM2BKDM5BKDM5AKDM4CKDM4A
SCHEMBL16094676 0.80 KDM5A (0.49) KDM2BKDM5BKDM5AKDM4CKDM4A
SCHEMBL16095431 0.77 KDM5B (0.41) KDM2BKDM5BKDM5AKDM4CKDM4A
SCHEMBL16034926 0.76 KDM5A (0.73) KDM2BKDM5BKDM5AKDM4CKDM4A
SCHEMBL16095206 0.76 KDM4C (0.64) KDM2BKDM5BKDM5AKDM4CKDM4A
SCHEMBL16095328 0.75 KDM4C (0.43) KDM2BKDM5BKDM5AKDM4CKDM4A
SCHEMBL16095345 0.74 KDM4C (0.44) KDM5BKDM5AKDM4CKDM4AKDM5C

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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