SCHEMBL7416663

SCHEMBL7416663

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

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 3/20 0.62
SLC1A2 P43004 3/20 0.62
SLC1A1 P43005 3/20 0.62
CASP1 P29466 6/20 0.55
ITGAV P06756 2/20 0.52
ATM Q13315 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ITGA2 P17301 1/20 0.46
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
KAT6A Q92794 1/20 0.41
ADAMTS4 O75173 1/20 0.41
CA12 O43570 1/20 0.41
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL6669839 0.82 ITGAV (0.66) SLC1A3SLC1A2SLC1A1CASP1ITGAV
SCHEMBL6669846 0.82 ITGAV (0.66) SLC1A3SLC1A2SLC1A1CASP1ITGAV
SCHEMBL7376542 0.80 SLC1A3 (0.57) SLC1A3SLC1A2SLC1A1ATML3MBTL1
SCHEMBL27525484 0.76 ATM (0.61) SLC1A3SLC1A2SLC1A1CASP1ITGAV
SCHEMBL27559330 0.76 L3MBTL1 (0.61) SLC1A3SLC1A2SLC1A1CASP1ITGAV
SCHEMBL6250115 0.76 SLC1A3 (0.60) SLC1A3SLC1A2SLC1A1ATML3MBTL1
SCHEMBL14798294 0.75 SLC1A3 (0.64) SLC1A3SLC1A2SLC1A1CASP1ITGAV
SCHEMBL27895996 0.75 SLC1A3 (0.64) SLC1A3SLC1A2SLC1A1CASP1ITGAV
SCHEMBL10765699 0.75 SLC1A3 (0.64) SLC1A3SLC1A2SLC1A1CASP1ITGAV
SCHEMBL5777753 0.75 FABP4 (0.50) ITGAVATML3MBTL1CA1CA2

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-5821241-A INHIBIT BINDING OF FIBRINOGEN TO BLOOD PLATELETS, INHIBIT AGGREGATION OF BLOOD PLATELETS, PREVENT OR TREAT THROMBUS OR EMBOLUS FORMATION MERCK & CO., INC. (US) 1998-10-13 US disclosed
WO-1994018981-A1 FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1994-09-01 WO disclosed