SCHEMBL31566321

SCHEMBL31566321

CC(C)c1ccccc1-c1nc(Cl)nc2c1ncn2C

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CDK1 P06493 4/20 0.48
▸ YTHDC1 Q96MU7 2/20 0.46
▸ CDK2 P24941 2/20 0.38
▸ CCNE2 O96020 1/20 0.38
▸ CCNE1 P24864 1/20 0.38
▸ CCNA2 P20248 1/20 0.36
▸ CCNA1 P78396 1/20 0.36
▸ CDK5 Q00535 1/20 0.36
▸ DYRK1A Q13627 1/20 0.36
▸ CDK5R1 Q15078 1/20 0.36
▸ USP1 O94782 3/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ MAPK14 Q16539 1/20 0.34

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
SCHEMBL14891975 0.81 CDK1 (0.57) CDK1YTHDC1CDK2CCNE2CCNE1
SCHEMBL31566326 0.78 LMNA (0.38) USP1
SCHEMBL31042997 0.77 CDK1 (0.56) CDK1YTHDC1CDK2CCNE2CCNE1
SCHEMBL31566299 0.73 DYRK1A (0.37) DYRK1AUSP1
SCHEMBL31566301 0.72 ATR (0.36) CDK1USP1ADORA1
SCHEMBL31566328 0.71 TSHR (0.41) USP1
SCHEMBL31566306 0.71 IKBKB (0.35) CDK2USP1
SCHEMBL31566298 0.70 ATR (0.35) USP1
SCHEMBL31566327 0.70 USP1 (0.34) USP1
SCHEMBL29931559 0.69 CDK1 (0.46) CDK1YTHDC1DYRK1A

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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