SCHEMBL31491295

SCHEMBL31491295

FC(F)(F)c1ncccc1CNc1nc(Cl)nc2c1SCC2

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CD38 P28907 1/20 0.36
▸ PDE1A P54750 4/20 0.33
▸ PDE1B Q01064 4/20 0.33
▸ PDE1C Q14123 4/20 0.33
▸ PTK2 Q05397 11/20 0.33
▸ PTK2B Q14289 2/20 0.33
▸ TRPC5 Q9UL62 1/20 0.32
▸ CASP6 P55212 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
SCHEMBL31491369 0.77 CD38 (0.35) CD38PDE1APDE1BPDE1CTRPC5
SCHEMBL20399092 0.75 PIP4K2C (0.46) CD38PDE1APDE1BPDE1C
SCHEMBL20399075 0.75 CD38 (0.41) CD38PDE1APDE1BPDE1C
SCHEMBL20400596 0.74 APP (0.56) CD38
SCHEMBL2917889 0.69 KMT2A (0.36) PDE1B
SCHEMBL31491388 0.68 PDE10A (0.44) —
SCHEMBL31566344 0.68 PDE2A (0.39) —
SCHEMBL13780256 0.67 P2RX7 (0.42) —
SCHEMBL21098219 0.65 KMT2A (0.43) PDE1B
SCHEMBL20399069 0.64 CD38 (0.43) CD38PTK2

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-2025067168-A1 AZA FUSED RING COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2025-04-03 — — WO disclosed
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