SCHEMBL19101737

SCHEMBL19101737

N#Cc1cccc2c1CN(CCn1cnc(-c3cc(C(O)O)ccn3)c1)C2

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM2B Q8NHM5 5/20 0.40
▸ KDM5A P29375 4/20 0.39
▸ KDM5B Q9UGL1 4/20 0.39
▸ KDM4C Q9H3R0 10/20 0.37
▸ KDM4A O75164 4/20 0.37
▸ PHF8 Q9UPP1 4/20 0.34
▸ PRMT5 O14744 2/20 0.33
▸ WDR77 Q9BQA1 1/20 0.33

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
SCHEMBL19101734 0.86 KDM2B (0.41) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL19139044 0.86 KDM2B (0.47) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL16033654 0.84 KDM2B (0.61) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL19101674 0.77 KDM4C (0.46) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL19101701 0.77 KDM4C (0.47) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL19102093 0.74 KDM2B (0.41) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL16033404 0.70 KDM2B (0.64) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL16033410 0.68 KDM2B (0.74) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL18612739 0.67 KDM4C (0.71) KDM2BKDM5AKDM5BKDM4CKDM4A
SCHEMBL19101706 0.66 KDM5A (0.67) 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
US-9701657-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2017-07-11 — — US disclosed
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