SCHEMBL30477289

SCHEMBL30477289

CC(C(=O)NC(CC(=O)O)C(=O)CF)N1Cc2ccc(-c3coc4ccccc34)cc2C1=O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 13/20 0.39
CASP3 P42574 4/20 0.39
SDCBP O00560 2/20 0.39
SDC2 P34741 2/20 0.39
CASP7 P55210 1/20 0.37
CASP9 P55211 1/20 0.37
CASP6 P55212 1/20 0.37
CASP8 Q14790 1/20 0.37

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
SCHEMBL25331664 1.00 MAPK1 (0.39) MAPK1CASP3SDCBPSDC2CASP7
SCHEMBL30477272 0.92 SDCBP (0.44) CASP3SDCBPSDC2CASP7CASP9
SCHEMBL25329555 0.92 SDCBP (0.44) CASP3SDCBPSDC2CASP7CASP9
SCHEMBL25329559 0.92 SDCBP (0.44) CASP3SDCBPSDC2CASP7CASP9
SCHEMBL25329465 0.91 SDCBP (0.41) MAPK1CASP3SDCBPSDC2
SCHEMBL30477328 0.91 SDCBP (0.41) MAPK1CASP3SDCBPSDC2
SCHEMBL31122073 0.89 SDCBP (0.42) MAPK1SDCBPSDC2
SCHEMBL30477300 0.85 MAPK1 (0.39) MAPK1
SCHEMBL25332033 0.85 MAPK1 (0.39) MAPK1
SCHEMBL25330760 0.84 SDCBP (0.41) CASP3SDCBPSDC2

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 4 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 claimed
CN-118510754-A Novel isoindolinone derivative compounds as caspase inhibitors 因诺沃治疗有限公司 2024-08-16 CN claimed
CN-118510754-A Novel isoindolinone derivative compounds as caspase inhibitors 因诺沃治疗有限公司 2024-08-16 CN disclosed
WO-2023132606-A1 NOVEL ISOINDOLINONE DERIVATIVE COMPOUNDS AS CASPASE INHIBITORS 주식회사 이노보테라퓨틱스 2023-07-13 WO disclosed