SCHEMBL6814072

SCHEMBL6814072

O=C(Nc1ccc(Br)cc1C(=O)O)c1csc(S(=O)(=O)N2CCc3ccc(Cl)cc32)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.49
PPARD Q03181 7/20 0.49
PPARA Q07869 7/20 0.49
DNMT3A Q9Y6K1 1/20 0.47
CPT1A P50416 7/20 0.46
CPT1B Q92523 7/20 0.46
CPT2 P23786 5/20 0.46
ALB P02768 2/20 0.43
SERPINE1 P05121 1/20 0.41

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
SCHEMBL6833907 0.89 PPARG (0.57) PPARGPPARDPPARAALB
SCHEMBL6357406 0.86 CPT1A (0.54) PPARGPPARDPPARADNMT3ACPT1A
SCHEMBL6359987 0.84 PPARG (0.65) PPARGPPARDPPARACPT1ACPT1B
SCHEMBL6353169 0.82 CPT1A (0.53) PPARGPPARDPPARADNMT3ACPT1A
SCHEMBL6351726 0.81 MAPT (0.50) PPARGPPARDPPARADNMT3ACPT1A
SCHEMBL6830627 0.81 CPT1A (0.46) PPARGPPARDPPARADNMT3ACPT1A
SCHEMBL6813966 0.79 SERPINE1 (0.52) PPARGPPARDPPARADNMT3AALB
SCHEMBL15788196 0.79 MAPT (0.61) PPARGPPARDPPARA
SCHEMBL6351997 0.79 CPT2 (0.48) PPARGPPARDPPARADNMT3ACPT1A
SCHEMBL6351239 0.77 PPARG (0.65) PPARGPPARDPPARAALB

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
US-20040110802-A1 Antibacterial benzoic acid derivatives PHARMACIA & UPJOHN COMPANY 2004-06-10 US disclosed
WO-2004018428-A1 ANTIBACTERIAL BENZOIC ACID DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-03-04 WO disclosed

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-20040110802-A1 Antibacterial benzoic acid derivatives GABRD, GABBR1, GABRA1 PPARG 285/4885PPARD 123/4885PPARA 134/4885

“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.