SCHEMBL20978893

SCHEMBL20978893

NN/N=C(\N)c1ccnc(-c2cn(CCN3CCCC3)cn2)c1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM2B Q8NHM5 6/20 0.65
▸ KDM5A P29375 8/20 0.54
▸ KDM5B Q9UGL1 8/20 0.54
▸ KDM4C Q9H3R0 11/20 0.51
▸ KDM4A O75164 3/20 0.51

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
SCHEMBL16033424 0.79 KDM2B (1.00) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978963 0.78 KDM2B (0.44) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978856 0.78 KDM4C (0.68) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978753 0.78 KDM4C (0.52) KDM5AKDM5BKDM4CKDM4A
SCHEMBL16032737 0.77 KDM2B (0.74) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978756 0.77 KDM4C (0.54) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20979042 0.77 KDM4C (0.69) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20979069 0.76 KDM4C (0.53) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978754 0.76 PHF8 (0.58) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL20978846 0.75 PHF8 (0.54) 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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