SCHEMBL31117528

SCHEMBL31117528

Cc1ccc(C(=O)N2CCc3[nH]c4ccc(-c5ccc(C)cc5)cc4c3C2)cc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 6/20 0.66
▸ CCND1 P24385 6/20 0.66
▸ BAZ2B Q9UIF8 7/20 0.64
▸ LMNA P02545 1/20 0.59
▸ PABPC1 P11940 1/20 0.59
▸ ATM Q13315 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ TRPV1 Q8NER1 1/20 0.58
▸ NPC1 O15118 1/20 0.55
▸ CFTR P13569 1/20 0.55
▸ MEN1 O00255 1/20 0.53
▸ USP2 O75604 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ CASP1 P29466 1/20 0.53
▸ CASP7 P55210 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ SIRT2 Q8IXJ6 1/20 0.53

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
SCHEMBL31117658 0.96 CDK4 (0.67) CDK4CCND1BAZ2BLMNAPABPC1
SCHEMBL31117483 0.95 CDK4 (0.66) CDK4CCND1BAZ2BLMNAPABPC1
SCHEMBL31117502 0.93 BAZ2B (0.61) CDK4CCND1BAZ2BLMNAPABPC1
SCHEMBL31117532 0.93 CDK4 (0.58) CDK4CCND1BAZ2BLMNAPABPC1
SCHEMBL31117407 0.92 CDK4 (0.57) CDK4CCND1BAZ2BLMNAPABPC1
SCHEMBL31117496 0.91 CDK4 (0.66) CDK4CCND1BAZ2BLMNAPABPC1
SCHEMBL31117472 0.90 BAZ2B (0.55) CDK4CCND1BAZ2BLMNAPABPC1
SCHEMBL31117391 0.89 CDK4 (0.56) CDK4CCND1BAZ2BLMNAPABPC1
SCHEMBL31117575 0.87 TRPV1 (0.68) CDK4CCND1BAZ2BLMNATRPV1
SCHEMBL32663524 0.87 CDK4 (0.57) CDK4CCND1BAZ2BLMNAPABPC1

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
EP-4682146-A1 COMPOSITION INCLUDING NOVEL PYRIDOINDOLE DERIVATIVE COMPOUND AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE DISEASES Neurotarge Co., Ltd. (KR) 2026-01-21 — — EP disclosed
WO-2024191255-A1 COMPOSITION INCLUDING NOVEL PYRIDOINDOLE DERIVATIVE COMPOUND AS ACTIVE INGREDIENT FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE DISEASES 한국과학기술연구원 2024-09-19 — — WO disclosed
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