SCHEMBL7280760

SCHEMBL7280760

CCCCS(=O)(=O)NC(Cc1ccc(OCCCCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)C(=O)OC

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 9/20 0.62
ITGA2B P08514 9/20 0.62
ITGAV P06756 1/20 0.62
CHRM2 P08172 1/20 0.62
SLC6A4 P31645 1/20 0.62
GPR119 Q8TDV5 9/20 0.58
YAP1 P46937 2/20 0.54

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
SCHEMBL7279447 0.94 ITGB3 (0.72) ITGB3ITGA2BITGAVCHRM2SLC6A4
Hydrochloric Acid SCHEMBL8862301 0.93 ITGB3 (0.71) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7282956 0.90 YAP1 (0.64) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7318632 0.89 GPR119 (0.56) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7320543 0.86 GPR119 (0.59) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7280754 0.86 GPR119 (0.48) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7280345 0.86 ITGB3 (0.62) ITGB3ITGA2BGPR119YAP1
SCHEMBL7442795 0.85 ITGB3 (0.61) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7279791 0.85 ITGB3 (0.63) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7273556 0.84 ITGB3 (0.71) ITGB3ITGA2BITGAVCHRM2SLC6A4

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6040317-A AN ANTIAGGLOMERANTS USEFUL IN THE PREVENTION AND TREATMENT OF DISEASES CAUSED BY THROMBUS FORMATION MERCK & CO., INC. (US) 2000-03-21 US disclosed
EP-0743302-B1 Sulfonamide fibrinogen receptor antagonists MERCK & CO INC (US) 1999-08-04 EP disclosed
US-5658929-A ANTICOAGULANTS MERCK & CO., INC. (US) 1997-08-19 US disclosed
EP-0478363-B1 Novel sulfonamide fibrinogen receptor antagonists MERCK & CO INC (US) 1997-03-19 EP disclosed
EP-0743302-A2 Sulfonamide fibrinogen receptor antagonists MERCK & CO. INC. (US) 1996-11-20 EP disclosed
US-5292756-A Novel sulfonamide fibrinogen receptor antagonists MERCK & CO., INC. (US) 1994-03-08 US disclosed
WO-1993019046-A1 NOVEL SULFONAMIDE FIBRINOGEN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 1993-09-30 WO disclosed
EP-0478363-A2 Novel sulfonamide fibrinogen receptor antagonists MERCK & CO. INC. (US) 1992-04-01 EP disclosed