SCHEMBL31587320

SCHEMBL31587320

O=C(Cc1ccn(-c2cc(Cl)ccn2)n1)Nc1cc(C2CC2)n[nH]1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 10/20 0.39
▸ CDK2 P24941 10/20 0.39
▸ GSK3B P49841 4/20 0.38
▸ CRACR2A Q9BSW2 1/20 0.36
▸ KDM5A P29375 4/20 0.35
▸ KDM4C Q9H3R0 4/20 0.35
▸ KDM5B Q9UGL1 4/20 0.35
▸ KDM2B Q8NHM5 1/20 0.35
▸ KDM4A O75164 1/20 0.35
▸ AR P10275 3/20 0.34
▸ CACNA1G O43497 1/20 0.33
▸ CACNA1H O95180 1/20 0.33
▸ CACNA1I Q9P0X4 1/20 0.33
▸ P2RX7 Q99572 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
SCHEMBL31587008 0.90 CDK2 (0.38) CCNE1CDK2GSK3BCRACR2AKDM5A
SCHEMBL31587024 0.88 CRACR2A (0.44) CCNE1CDK2GSK3BCRACR2AKDM5A
SCHEMBL31586967 0.85 KCNJ6 (0.41) CCNE1CDK2CRACR2AAR
SCHEMBL31587183 0.84 CDK2 (0.53) CCNE1CDK2GSK3B
SCHEMBL31587153 0.83 CDK2 (0.36) CCNE1CDK2GSK3BCRACR2AAR
SCHEMBL31587062 0.83 CDK2 (0.37) CCNE1CDK2GSK3BCRACR2AAR
SCHEMBL31587991 0.81 CRACR2A (0.38) CCNE1CDK2GSK3BCRACR2AAR
SCHEMBL31586737 0.81 AR (0.35) CCNE1CDK2GSK3BCRACR2AAR
SCHEMBL31588043 0.80 AR (0.35) CCNE1CDK2GSK3BCRACR2AAR
SCHEMBL31587271 0.80 AR (0.49) ARCACNA1GCACNA1HCACNA1I

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
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