SCHEMBL30477291

SCHEMBL30477291

CCC(C(=O)NC(CC(=O)O)C(=O)CF)N1Cc2ccc(-c3ccnc4ccccc34)cc2C1=O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 7/20 0.42
SDCBP O00560 6/20 0.40
SDC2 P34741 6/20 0.40
CREBBP Q92793 1/20 0.37
CASP3 P42574 3/20 0.36
CASP1 P29466 2/20 0.36
CASP7 P55210 1/20 0.36
CASP8 Q14790 1/20 0.36
EGFR P00533 1/20 0.35
ACVR1 Q04771 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
SCHEMBL25331038 1.00 MAPK1 (0.42) MAPK1SDCBPSDC2CREBBPCASP3
SCHEMBL25331331 0.95 SDCBP (0.39) MAPK1SDCBPSDC2CREBBPCASP1
SCHEMBL30477311 0.95 SDCBP (0.39) MAPK1SDCBPSDC2CREBBPCASP1
SCHEMBL30477324 0.88 SDCBP (0.43) MAPK1SDCBPSDC2CASP3CASP1
SCHEMBL25333877 0.88 SDCBP (0.43) MAPK1SDCBPSDC2CASP3CASP1
SCHEMBL25331706 0.87 SDCBP (0.50) MAPK1SDCBPSDC2CASP3CASP7
SCHEMBL30477296 0.87 SDCBP (0.50) MAPK1SDCBPSDC2CASP3CASP7
SCHEMBL30477317 0.85 MET (0.42) MAPK1SDCBPSDC2CASP1EGFR
SCHEMBL25332196 0.85 MET (0.42) MAPK1SDCBPSDC2CASP1EGFR
SCHEMBL25330487 0.85 MAPK1 (0.43) MAPK1SDCBPSDC2CASP1

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-4461726-A1 NOVEL ISOINDOLINONE DERIVATIVE COMPOUNDS AS CASPASE INHIBITORS Innovo Therapeutics Inc. (KR) 2024-11-13 EP disclosed
WO-2023132606-A1 NOVEL ISOINDOLINONE DERIVATIVE COMPOUNDS AS CASPASE INHIBITORS 주식회사 이노보테라퓨틱스 2023-07-13 WO disclosed