SCHEMBL10765699

SCHEMBL10765699

Cc1ccccc1S(=O)(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.64
SLC1A2 P43004 1/20 0.64
SLC1A1 P43005 1/20 0.64
ADAMTS4 O75173 1/20 0.58
ITGAV P06756 2/20 0.57
CASP1 P29466 4/20 0.49
ITGA2 P17301 1/20 0.49
HTT P42858 2/20 0.49
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP3 P08254 1/20 0.48
MMP7 P09237 1/20 0.48
MMP9 P14780 1/20 0.48
MMP13 P45452 1/20 0.48
ALDH1A1 P00352 1/20 0.46
CYP2C19 P33261 1/20 0.46
KAT6A Q92794 1/20 0.44
ALOX5AP P20292 1/20 0.44
FEN1 P39748 1/20 0.44
ATM Q13315 1/20 0.44

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
SCHEMBL27895996 1.00 SLC1A3 (0.64) SLC1A3SLC1A2SLC1A1ADAMTS4ITGAV
SCHEMBL14798294 1.00 SLC1A3 (0.64) SLC1A3SLC1A2SLC1A1ADAMTS4ITGAV
SCHEMBL9276421 0.86 ADAMTS4 (0.50) SLC1A3SLC1A2SLC1A1ADAMTS4ITGAV
SCHEMBL1906773 0.85 SLC1A3 (0.58) SLC1A3SLC1A2SLC1A1ADAMTS4ITGAV
Phenanthroline SCHEMBL27890313 0.84 SLC40A1 (0.56) SLC1A3SLC1A2SLC1A1ADAMTS4ITGAV
SCHEMBL4588941 0.84 SLC1A3 (0.74) SLC1A3SLC1A2SLC1A1ADAMTS4ITGAV
SCHEMBL3964633 0.84 SLC1A3 (0.74) SLC1A3SLC1A2SLC1A1ADAMTS4ITGAV
SCHEMBL15918110 0.82 ADAMTS4 (0.56) SLC1A3SLC1A2SLC1A1ADAMTS4HTT
SCHEMBL15923698 0.82 ADAMTS4 (0.56) SLC1A3SLC1A2SLC1A1ADAMTS4HTT
SCHEMBL27388236 0.82 ADAMTS4 (0.56) SLC1A3SLC1A2SLC1A1ADAMTS4HTT

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-4716222-A CHROMOGENS, SPECTROPHOTOMETRY HOECHST AKTIENGESELLSCHAFT (DE) 1987-12-29 US disclosed