SCHEMBL16092262

SCHEMBL16092262

Cc1ccc(-n2cc(-c3[nH]c4c(C#N)cnn4c(=O)c3C(C)C)cn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 13/20 0.47
▸ KDM5B Q9UGL1 6/20 0.39
▸ KDM5C P41229 2/20 0.35
▸ KDM4C Q9H3R0 1/20 0.35
▸ PTGS2 P35354 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
SCHEMBL17547857 0.91 KDM5B (0.48) KDM5AKDM5BKDM5CKDM4C
SCHEMBL16092232 0.91 KDM5A (0.57) KDM5AKDM5BKDM5CKDM4C
SCHEMBL16092231 0.90 KDM5A (0.47) KDM5AKDM5BKDM5CKDM4C
SCHEMBL16092263 0.89 KDM5A (0.47) KDM5AKDM5BKDM5CKDM4C
SCHEMBL16092317 0.88 KDM5A (0.48) KDM5AKDM5BKDM5CKDM4CPTGS2
SCHEMBL16092096 0.86 KDM5A (0.47) KDM5AKDM5BKDM5CKDM4C
SCHEMBL17547856 0.84 KDM5A (0.46) KDM5AKDM5B
SCHEMBL16092253 0.82 KDM5A (0.53) KDM5AKDM5BKDM5CKDM4C
SCHEMBL16092474 0.82 GRM5 (0.44) KDM5AKDM5BKDM5CKDM4C
SCHEMBL16092352 0.81 KDM5A (0.53) KDM5AKDM5BKDM5CKDM4C

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
WO-2015135094-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2015-09-17 — — WO disclosed
WO-2014139326-A1 PYRAZOLO COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2014-09-18 — — WO disclosed
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