SCHEMBL31517705

SCHEMBL31517705

Cc1cnc(-n2cc(CC(=O)Nc3cc(C4CC4)n[nH]3)cn2)s1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 18/20 0.37
▸ CDK2 P24941 18/20 0.37
▸ GSK3B P49841 10/20 0.37
▸ ALOX12 P18054 1/20 0.34
▸ MAPK10 P53779 1/20 0.34
▸ SMN1; SMN2 Q16637 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
SCHEMBL31517561 0.86 CCNE1 (0.37) CCNE1CDK2GSK3B
SCHEMBL31517548 0.84 CCNE1 (0.36) CCNE1CDK2GSK3B
SCHEMBL31517479 0.83 CDK2 (0.53) CCNE1CDK2GSK3B
SCHEMBL31517532 0.83 CDK2 (0.36) CCNE1CDK2GSK3B
SCHEMBL31587604 0.83 CCNE1 (0.36) CCNE1CDK2GSK3B
SCHEMBL31516851 0.81 CCNE1 (0.38) CCNE1CDK2GSK3B
SCHEMBL31516946 0.81 CDK2 (0.37) CCNE1CDK2GSK3BMAPK10SMN1; SMN2
SCHEMBL31516900 0.81 CCNE1 (0.36) CCNE1CDK2GSK3B
SCHEMBL31517227 0.80 CDK2 (0.44) CCNE1CDK2GSK3BMAPK10
SCHEMBL31516893 0.79 CDK2 (0.37) CCNE1CDK2GSK3B

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