SCHEMBL31566306

SCHEMBL31566306

CNc1cc2c(ncn2C)c(-c2ccccc2C(C)C)n1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 7/20 0.35
▸ CHUK O15111 7/20 0.35
▸ MAT2A P31153 1/20 0.35
▸ USP1 O94782 5/20 0.33
▸ WDR48 Q8TAF3 2/20 0.33
▸ TRPC5 Q9UL62 1/20 0.32
▸ PIP4K2C Q8TBX8 1/20 0.32
▸ CTSL P07711 1/20 0.32
▸ TRPA1 O75762 1/20 0.32
▸ DPP4 P27487 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CDK2 P24941 2/20 0.31
▸ BTK Q06187 2/20 0.31
▸ ITK Q08881 2/20 0.31
▸ IKBKE Q14164 2/20 0.31
▸ PLK1 P53350 1/20 0.31
▸ GRM5 P41594 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
SCHEMBL31566299 0.82 DYRK1A (0.37) USP1WDR48TRPC5PIP4K2CCTSL
SCHEMBL31566326 0.82 LMNA (0.38) USP1TRPC5PIP4K2CTRPA1DPP4
SCHEMBL31566327 0.80 USP1 (0.34) USP1TRPC5PIP4K2CTRPA1DPP4
SCHEMBL31566328 0.77 TSHR (0.41) USP1TRPC5PIP4K2CDPP4GRM5
SCHEMBL31566330 0.75 USP1 (0.34) USP1WDR48DPP4KMT2AGRM5
SCHEMBL31566332 0.73 MEN1 (0.34) USP1MEN1KMT2A
SCHEMBL31566321 0.71 CDK1 (0.48) USP1CDK2
SCHEMBL31566297 0.71 BRD4 (0.36) USP1TRPC5
SCHEMBL31566301 0.69 ATR (0.36) IKBKBCHUKUSP1WDR48PIP4K2C
SCHEMBL18409182 0.68 CDK1 (0.42) IKBKBCHUKCDK2

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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