SCHEMBL20978804

SCHEMBL20978804

CN(C)CCOCCN1C=C(c2cc(C(=O)O)ccn2)NC1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KDM2B Q8NHM5 7/20 0.63
▸ KDM5A P29375 5/20 0.50
▸ KDM5B Q9UGL1 5/20 0.50
▸ KDM4C Q9H3R0 6/20 0.41
▸ KDM4A O75164 3/20 0.41
▸ JMJD6 Q6NYC1 1/20 0.41
▸ KDM5C P41229 5/20 0.40
▸ KDM2A Q9Y2K7 3/20 0.40
▸ KDM3A Q9Y4C1 3/20 0.40
▸ KDM6B O15054 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ KDM4B O94953 1/20 0.37

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
SCHEMBL20978805 0.89 KDM5B (0.59) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978783 0.80 KDM2B (0.64) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978718 0.79 KDM4C (0.63) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL16033778 0.78 KDM2B (1.00) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20979006 0.76 JMJD6 (0.54) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978807 0.75 KDM5B (0.62) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978815 0.75 KDM4C (0.48) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978910 0.74 KDM5A (0.60) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978859 0.74 KDM2B (0.44) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978802 0.72 KDM4C (0.41) KDM2BKDM5AKDM5BKDM4CKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2969007-B1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2019-05-08 — — EP disclosed
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