SCHEMBL31587757

SCHEMBL31587757

Cc1csc(-n2ccc(CC(=O)Nc3cc(C4CC4)n[nH]3)n2)n1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 14/20 0.35
▸ CDK2 P24941 14/20 0.35
▸ KCNJ6 P48051 1/20 0.35
▸ KCNJ3 P48549 1/20 0.35
▸ GSK3B P49841 5/20 0.34
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ SHMT1 P34896 1/20 0.33
▸ SHMT2 P34897 1/20 0.33
▸ GLS O94925 1/20 0.33

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
SCHEMBL31587015 0.90 CCNE1 (0.36) CCNE1CDK2GSK3BSHMT1SHMT2
SCHEMBL31587731 0.85 CCNE1 (0.39) CCNE1CDK2KCNJ6KCNJ3GSK3B
SCHEMBL31587155 0.84 CDK2 (0.50) CCNE1CDK2GSK3B
SCHEMBL31587604 0.84 CCNE1 (0.36) CCNE1CDK2GSK3BNPC1RAB9A
SCHEMBL31587991 0.83 CRACR2A (0.38) CCNE1CDK2GSK3BGLS
SCHEMBL31587181 0.83 CDK2 (0.38) CCNE1CDK2KCNJ6KCNJ3GSK3B
SCHEMBL31517548 0.82 CCNE1 (0.36) CCNE1CDK2GSK3BNPC1RAB9A
SCHEMBL31586737 0.81 AR (0.35) CCNE1CDK2GSK3BGLS
SCHEMBL31587666 0.80 CDK2 (0.40) CCNE1CDK2KCNJ6KCNJ3
SCHEMBL31587062 0.80 CDK2 (0.37) CCNE1CDK2GSK3BGLS

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-2025104236-A1 PYRAZOLE COMPOUNDS AS CULLIN RING UBIQUITIN LIGASE COMPOUNDS PROXYGEN GMBH (AT) 2025-05-22 — — WO claimed
WO-2025104236-A1 PYRAZOLE COMPOUNDS AS CULLIN RING UBIQUITIN LIGASE COMPOUNDS PROXYGEN GMBH (AT) 2025-05-22 — — WO disclosed
Send feedback