SCHEMBL9519643

SCHEMBL9519643

CC(=O)OCc1ccc(C(=O)NS(=O)(=O)C(C=O)c2cccc(F)c2)cn1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.39
CASP3 P42574 5/20 0.38
CXCR1 P25024 1/20 0.36
CXCR2 P25025 1/20 0.36
GABRA5 P31644 1/20 0.36
HDAC6 Q9UBN7 1/20 0.35
P4HTM Q9NXG6 2/20 0.35
SLC6A9 P48067 1/20 0.35
SLC6A5 Q9Y345 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
SCHEMBL9516262 0.90 GRM5 (0.40) GRM5CASP3CXCR1CXCR2GABRA5
SCHEMBL9515607 0.89 EPHX2 (0.40) CASP3CXCR1CXCR2GABRA5HDAC6
SCHEMBL9519634 0.89 HDAC1 (0.39) CASP3HDAC6
SCHEMBL9517229 0.87 POLB (0.38) GRM5CASP3CXCR1CXCR2GABRA5
SCHEMBL9517025 0.87 CASP3 (0.39) GRM5CASP3HDAC6P4HTMSLC6A9
SCHEMBL9515669 0.85 LMNA (0.38) GRM5CASP3CXCR1CXCR2GABRA5
SCHEMBL9517314 0.84 P4HTM (0.36) CASP3HDAC6P4HTM
SCHEMBL9519649 0.83 GRM5 (0.38) GRM5CASP3CXCR1CXCR2GABRA5
SCHEMBL9517259 0.83 EGFR (0.39) CASP3GABRA5P4HTM
SCHEMBL9517222 0.83 TRPM8 (0.38) CASP3HDAC6P4HTM

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
EP-0567997-A1 4- or 5-(sulf)imido- and (sulfon)amidopyridines and their pyridine-N-oxides, process for their preparation and their use as pharmaceutical HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-03 EP disclosed