SCHEMBL31516769

SCHEMBL31516769

COc1cccc(-n2cc(C(C)C(=O)Nc3cc(C4CC4)[nH]n3)cn2)n1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 19/20 0.57
▸ CDK2 P24941 19/20 0.57
▸ CCNA1 P78396 19/20 0.57
▸ CDK7 P50613 1/20 0.48
▸ CDK13 Q14004 1/20 0.48
▸ CDK12 Q9NYV4 1/20 0.48

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
SCHEMBL31517366 1.00 CCNA2 (0.57) CCNA2CDK2CCNA1CDK7CDK13
SCHEMBL31516890 1.00 CCNA2 (0.57) CCNA2CDK2CCNA1CDK7CDK13
SCHEMBL31517033 0.85 CCNA2 (0.38) CCNA2CDK2CCNA1CDK13CDK12
SCHEMBL31516957 0.85 CCNA2 (0.38) CCNA2CDK2CCNA1CDK13CDK12
SCHEMBL31516914 0.85 CCNA2 (0.38) CCNA2CDK2CCNA1CDK13CDK12
SCHEMBL31516884 0.83 CCNA2 (0.55) CCNA2CDK2CCNA1CDK7CDK13
SCHEMBL31517562 0.83 CCNA2 (0.55) CCNA2CDK2CCNA1CDK7CDK13
SCHEMBL31516836 0.83 CCNA2 (0.55) CCNA2CDK2CCNA1CDK7CDK13
SCHEMBL31516980 0.82 CDK2 (0.60) CCNA2CDK2CCNA1
SCHEMBL31516896 0.81 CCNA2 (0.61) CCNA2CDK2CCNA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025040546-A1 PYRAZOLE COMPOUNDS AS CULLIN RING UBIQUITIN LIGASE COMPOUNDS PROXYGEN GMBH (AT) 2025-02-27 — — WO claimed
WO-2025040546-A1 PYRAZOLE COMPOUNDS AS CULLIN RING UBIQUITIN LIGASE COMPOUNDS PROXYGEN GMBH (AT) 2025-02-27 — — WO disclosed
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