SCHEMBL16095566

SCHEMBL16095566

COc1ccccc1CCc1nc(-c2cc(C(=O)O)ccn2)c[nH]1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 11/20 0.61
▸ KDM4A O75164 6/20 0.61
▸ KDM5C P41229 4/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ KDM6B O15054 2/20 0.45
▸ KDM2A Q9Y2K7 2/20 0.45
▸ KDM3A Q9Y4C1 2/20 0.45
▸ KDM5B Q9UGL1 7/20 0.44
▸ KDM5A P29375 6/20 0.44
▸ NR3C2 P08235 1/20 0.43
▸ PHF8 Q9UPP1 1/20 0.41
▸ MRGPRX4 Q96LA9 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ KDM4B O94953 1/20 0.40
▸ BRS3 P32247 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
SCHEMBL16095193 0.86 KDM4C (0.59) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16094521 0.84 KDM5B (0.59) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16094800 0.83 KDM4C (0.61) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16095274 0.82 PHF8 (0.42) KDM4CKDM4AKDM5CKDM4EKDM5B
SCHEMBL16102028 0.81 KDM4C (0.44) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16096091 0.81 KDM4C (0.48) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16095249 0.80 KDM4C (0.57) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16094928 0.78 KDM5C (0.55) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16095770 0.78 KDM5B (0.45) KDM4CKDM4AKDM5CKDM4EKDM6B
SCHEMBL16095768 0.77 KDM4C (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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