SCHEMBL31587024

SCHEMBL31587024

O=C(Cc1ccn(-c2ccccn2)n1)Nc1cc(C2CC2)n[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRACR2A Q9BSW2 2/20 0.44
▸ GLS O94925 2/20 0.38
▸ MPO P05164 1/20 0.38
▸ TPO P07202 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CDK2 P24941 8/20 0.37
▸ CCNE1 P24864 7/20 0.37
▸ GSK3B P49841 2/20 0.37
▸ CCNA2 P20248 1/20 0.36
▸ CCNA1 P78396 1/20 0.36
▸ DRD4 P21917 2/20 0.36
▸ KDM5A P29375 2/20 0.36
▸ KDM4C Q9H3R0 2/20 0.36
▸ KDM5B Q9UGL1 2/20 0.36
▸ KDM2B Q8NHM5 1/20 0.36
▸ KDM4A O75164 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL31587320 0.88 CCNE1 (0.39) CRACR2ACDK2CCNE1GSK3BKDM5A
SCHEMBL31587008 0.87 CDK2 (0.38) CRACR2ACDK2CCNE1GSK3BCCNA2
SCHEMBL31587153 0.86 CDK2 (0.36) CRACR2ACDK2CCNE1GSK3BCCNA2
SCHEMBL31587181 0.85 CDK2 (0.38) CRACR2ACDK2CCNE1GSK3BCCNA2
SCHEMBL31587062 0.84 CDK2 (0.37) CRACR2AGLSCDK2CCNE1GSK3B
SCHEMBL5867800 0.83 CRACR2A (0.54) CRACR2AGLSCDK2CCNE1GSK3B
SCHEMBL31587348 0.83 CDK2 (0.58) CDK2CCNE1GSK3BCCNA2CCNA1
SCHEMBL31587991 0.82 CRACR2A (0.38) CRACR2AGLSCDK2CCNE1GSK3B
SCHEMBL31586967 0.82 KCNJ6 (0.41) CRACR2ACDK2CCNE1CCNA2CCNA1
SCHEMBL31587022 0.80 AR (0.49) CRACR2A

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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