SCHEMBL31489600

SCHEMBL31489600

Cc1ccc(C)n1-c1nc2ccccn2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.44
JAK3 P52333 1/20 0.44
CYP11B2 P19099 1/20 0.39
PDE10A Q9Y233 9/20 0.35
KDM4E B2RXH2 7/20 0.35
ALDH1A1 P00352 5/20 0.34
GAA P10253 4/20 0.34
GLA P06280 3/20 0.34
HPGD P15428 3/20 0.34
NPC1 O15118 2/20 0.34
HSD17B10 Q99714 2/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HTT P42858 2/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 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
SCHEMBL544142 0.75 JAK2 (0.50) JAK2JAK3CYP11B2PDE10AKDM4E
SCHEMBL31489689 0.75 AHR (0.50) PDE10AKDM4EALDH1A1NPC1HTT
SCHEMBL31489671 0.71 CA1 (0.32) KDM4E
SCHEMBL31489938 0.71 PDE10A (0.41) JAK2PDE10AKDM4EALDH1A1GAA
SCHEMBL15827807 0.71 JAK2 (0.50) JAK2JAK3CYP11B2PDE10AKDM4E
SCHEMBL10271750 0.70 JAK2 (0.46) JAK2JAK3CYP11B2PDE10AKDM4E
SCHEMBL31489179 0.69 KDM4E (0.35) JAK2PDE10AKDM4EALDH1A1NPC1
SCHEMBL27330270 0.68 JAK2 (0.36) JAK2JAK3CYP11B2PDE10AKDM4E
SCHEMBL21162487 0.68 PRKDC (0.47) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL18911313 0.68 PDE10A (0.49) JAK2JAK3CYP11B2PDE10AKDM4E

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
WO-2025072395-A1 TRIAZOLOPYRIDINYL COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-04-03 WO disclosed