SCHEMBL31489503

SCHEMBL31489503

Cc1ccc(C)n1-c1nc2cc(-c3cc(Cl)cnc3F)ccn2n1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 2/20 0.34
PIK3CG P48736 2/20 0.32
PIK3CD O00329 1/20 0.32
TDP2 O95551 1/20 0.31
BACE1 P56817 3/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL31489405 0.77 PDE10A (0.34) PDE10APIK3CGPIK3CD
SCHEMBL31489376 0.77 TDP2 (0.32) PDE10ATDP2
SCHEMBL31489371 0.74 PDE10A (0.37) PDE10APIK3CG
SCHEMBL31489910 0.73 CYP11B2 (0.37) PDE10APIK3CGPIK3CDTDP2
SCHEMBL31489179 0.71 KDM4E (0.35) PDE10ATDP2
SCHEMBL31489399 0.71 KDM4E (0.35) PDE10A
SCHEMBL31489203 0.71 PDE10A (0.32) PDE10A
SCHEMBL31489689 0.68 AHR (0.50) PDE10A
SCHEMBL31489671 0.65 CA1 (0.32)
SCHEMBL411023 0.63 BACE1 (0.44) BACE1KCNH2

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