SCHEMBL16095328

SCHEMBL16095328

CN(CCc1nc(-c2cc(C(=O)O)ccn2)c[nH]1)c1ccccc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 11/20 0.43
▸ KDM4A O75164 7/20 0.43
▸ KDM5C P41229 5/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ KDM6B O15054 3/20 0.40
▸ KDM2A Q9Y2K7 3/20 0.40
▸ KDM3A Q9Y4C1 3/20 0.40
▸ KDM5B Q9UGL1 7/20 0.39
▸ KDM5A P29375 7/20 0.39
▸ KDM2B Q8NHM5 1/20 0.38
▸ JMJD6 Q6NYC1 1/20 0.38
▸ ALKBH2 Q6NS38 1/20 0.37
▸ ALKBH3 Q96Q83 1/20 0.37
▸ FTO Q9C0B1 1/20 0.37
▸ KDM4B O94953 1/20 0.36
▸ MRGPRX4 Q96LA9 1/20 0.36

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
SCHEMBL16095345 0.87 KDM4C (0.44) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16095768 0.87 KDM4C (0.44) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16102028 0.83 KDM4C (0.44) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16094674 0.81 KDM4C (0.48) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16095329 0.79 EPHX2 (0.45) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16033751 0.77 KDM4C (0.73) KDM4CKDM4AKDM5BKDM5AKDM2B
SCHEMBL16095431 0.77 KDM5B (0.41) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16095331 0.75 KDM2B (0.55) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16095275 0.75 KDM4C (0.49) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16095088 0.75 KDM5B (0.44) KDM4CKDM4AKDM5CKDM4EKDM6B

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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