SCHEMBL31566299

SCHEMBL31566299

CC(C)c1ccccc1-c1nc(N)cc2c1ncn2C

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 2/20 0.37
▸ ALOX5AP P20292 1/20 0.37
▸ FEN1 P39748 1/20 0.37
▸ DHFR P00374 1/20 0.36
▸ DPP4 P27487 1/20 0.35
▸ ATR Q13535 1/20 0.34
▸ USP1 O94782 5/20 0.34
▸ TRPA1 O75762 1/20 0.33
▸ GRM5 P41594 1/20 0.32
▸ TRPC5 Q9UL62 1/20 0.31
▸ PIP4K2C Q8TBX8 1/20 0.31
▸ WDR48 Q8TAF3 1/20 0.31
▸ P2RX3 P56373 1/20 0.31
▸ P2RX2 Q9UBL9 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ CTSL P07711 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
SCHEMBL31566326 0.85 LMNA (0.38) DPP4USP1TRPA1GRM5TRPC5
SCHEMBL31566306 0.82 IKBKB (0.35) DPP4USP1TRPA1GRM5TRPC5
SCHEMBL31566327 0.81 USP1 (0.34) DPP4USP1TRPA1GRM5TRPC5
SCHEMBL31566328 0.79 TSHR (0.41) DPP4USP1GRM5TRPC5PIP4K2C
SCHEMBL31566330 0.77 USP1 (0.34) DPP4USP1GRM5WDR48
SCHEMBL31566301 0.76 ATR (0.36) ALOX5APFEN1DHFRDPP4ATR
SCHEMBL31566332 0.75 MEN1 (0.34) USP1CA12CA1CA2CA9
SCHEMBL31566298 0.74 ATR (0.35) DHFRDPP4ATRUSP1PIP4K2C
SCHEMBL31566321 0.73 CDK1 (0.48) DYRK1AUSP1
SCHEMBL31566317 0.72 ATR (0.36) DHFRATRUSP1PIP4K2CP2RX3

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-2025096505-A1 UBIQUITIN SPECIFIC PROCESSING PROTEASE 1 (USP1) COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-08 — — WO disclosed
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