SCHEMBL20978751

SCHEMBL20978751

CC(C)COc1ccccc1Cn1cnc(-c2cc(/C(N)=N/NN)ccn2)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 14/20 0.58
▸ KDM2B Q8NHM5 5/20 0.58
▸ KDM5B Q9UGL1 7/20 0.45
▸ KDM5A P29375 6/20 0.45
▸ KDM4A O75164 5/20 0.45
▸ CCR8 P51685 1/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ ADRB2 P07550 1/20 0.39
▸ ADRB1 P08588 1/20 0.39
▸ ADRB3 P13945 1/20 0.39
▸ PHF8 Q9UPP1 2/20 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
SCHEMBL20979023 0.86 KDM4C (0.57) KDM4CKDM2BKDM5BKDM5AKDM4A
SCHEMBL20979039 0.84 KDM4C (0.57) KDM4CKDM2BKDM5BKDM5AKDM4A
SCHEMBL20978846 0.82 PHF8 (0.54) KDM4CKDM2BKDM5BKDM5AKDM4A
SCHEMBL20978964 0.81 PHF8 (0.58) KDM4CKDM2BKDM5BKDM5AKDM4A
SCHEMBL20978873 0.80 KDM4C (0.56) KDM4CKDM2BKDM5BKDM5AKDM4A
SCHEMBL20979031 0.79 PHF8 (0.56) KDM4CKDM2BKDM5BKDM5AKDM4A
SCHEMBL16034914 0.76 KDM4C (0.62) KDM4CKDM2BKDM5BKDM5AKDM4A
SCHEMBL20979069 0.75 KDM4C (0.53) KDM4CKDM2BKDM5BKDM5AKDM4A
SCHEMBL20978753 0.74 KDM4C (0.52) KDM4CKDM5BKDM5AKDM4APHF8
SCHEMBL20978856 0.74 KDM4C (0.68) KDM4CKDM2BKDM5BKDM5AKDM4A

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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