SCHEMBL9515607

SCHEMBL9515607

CC(=O)OCc1ccc(C(=O)NS(=O)(=O)C(C=O)c2ccc(F)cc2)cn1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.40
P4HTM Q9NXG6 2/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
CYP2J2 P51589 1/20 0.37
CXCR1 P25024 4/20 0.36
CXCR2 P25025 4/20 0.36
HDAC6 Q9UBN7 2/20 0.35
CASP3 P42574 3/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
GABRA5 P31644 2/20 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
SCHEMBL9517259 0.90 EGFR (0.39) EPHX2P4HTMCASP3GABRA5
SCHEMBL9517222 0.90 TRPM8 (0.38) EPHX2P4HTMHDAC6CASP3HDAC3
SCHEMBL9517908 0.89 CXCR1 (0.39) EPHX2P4HTMCYP2C9CYP2C19CYP2J2
SCHEMBL9519643 0.89 GRM5 (0.39) P4HTMCXCR1CXCR2HDAC6CASP3
SCHEMBL9517088 0.88 CXCR2 (0.38) EPHX2P4HTMCYP2C9CYP2C19CYP2J2
SCHEMBL9517963 0.87 TLR4 (0.38) GABRA5
SCHEMBL9515669 0.87 LMNA (0.38) EPHX2P4HTMCXCR1CXCR2HDAC6
SCHEMBL9518019 0.86 MEN1 (0.39) EPHX2P4HTMCYP2C9CYP2C19CYP2J2
SCHEMBL9517314 0.85 P4HTM (0.36) EPHX2P4HTMHDAC6CASP3
SCHEMBL9519634 0.83 HDAC1 (0.39) HDAC6CASP3HDAC3HDAC1HDAC2

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