SCHEMBL31474740

SCHEMBL31474740

CCC(C(=O)NC(CC(=O)O)C(=O)CF)N1Cc2ccc(-c3ccc(C(F)(F)F)cc3)cc2C1=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SDCBP O00560 8/20 0.43
SDC2 P34741 8/20 0.43
MAPK1 P28482 5/20 0.39
THRB P10828 1/20 0.37
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ITGB3 P05106 1/20 0.35
ITGA2B P08514 1/20 0.35
ITGA2 P17301 1/20 0.35
CASP3 P42574 1/20 0.35
DGAT1 O75907 1/20 0.34

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
SCHEMBL25330658 1.00 SDCBP (0.43) SDCBPSDC2MAPK1THRBNPC1
SCHEMBL25331706 0.92 SDCBP (0.50) SDCBPSDC2MAPK1CASP3
SCHEMBL30477296 0.92 SDCBP (0.50) SDCBPSDC2MAPK1CASP3
SCHEMBL25330616 0.90 SDCBP (0.44) SDCBPSDC2MAPK1ITGB3ITGA2B
SCHEMBL30477326 0.90 SDCBP (0.44) SDCBPSDC2MAPK1ITGB3ITGA2B
SCHEMBL30477325 0.89 SDCBP (0.44) SDCBPSDC2MAPK1ITGB3ITGA2B
SCHEMBL25330514 0.88 MAPK1 (0.40) SDCBPSDC2MAPK1
SCHEMBL30477268 0.88 MAPK1 (0.40) SDCBPSDC2MAPK1
SCHEMBL25330944 0.86 SDCBP (0.41) SDCBPSDC2MAPK1CASP3
SCHEMBL30477320 0.86 SDCBP (0.41) SDCBPSDC2MAPK1CASP3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250109135-A1 NOVEL ISOINDOLINONE DERIVATIVE COMPOUNDS AS CASPASE INHIBITORS INNOVO THERAPEUTICS INC. (KR) 2025-04-03 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250109135-A1 NOVEL ISOINDOLINONE DERIVATIVE COMPOUNDS AS CASPASE INHIBITORS CASP1, CASP8, CASP2 SDCBP 3595/4885SDC2 4311/4885MAPK1 225/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.