SCHEMBL7330756

SCHEMBL7330756

CS(=O)(=O)Nc1cccc(C[C@H](NC(=O)OCc2ccccc2)C(=O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 7/20 0.57
ITGAV P06756 1/20 0.57
CTSL P07711 2/20 0.50
CTSB P07858 2/20 0.50
CTSS P25774 2/20 0.50
CTSK P43235 1/20 0.50
TYR P14679 1/20 0.50
ITGA2B P08514 6/20 0.49
ALDH1A1 P00352 1/20 0.49
ALOX15 P16050 1/20 0.49
TACR1 P25103 2/20 0.48
CTRB1 P17538 2/20 0.47
MGLL Q99685 1/20 0.47

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
SCHEMBL7330763 1.00 ITGB3 (0.57) ITGB3ITGAVCTSLCTSBCTSS
SCHEMBL7326409 0.90 ITGB3 (0.50) ITGB3ITGAVCTSLCTSBCTSS
SCHEMBL7323268 0.90 ITGB3 (0.50) ITGB3ITGAVCTSLCTSBCTSS
SCHEMBL5403293 0.89 GPR132 (0.56) ITGB3ITGAVITGA2B
SCHEMBL27509468 0.89 GPR132 (0.56) ITGB3ITGAVITGA2B
SCHEMBL6768390 0.89 ITGB3 (0.57) ITGB3ITGAVCTSLCTSBCTSS
SCHEMBL5392644 0.84 ITGB3 (0.60) ITGB3ITGAVITGA2BMGLL
SCHEMBL5400250 0.82 ITGB3 (0.52) ITGB3ITGAVITGA2B
SCHEMBL13536744 0.81 CTSK (0.62) ITGB3ITGAVCTSLCTSBCTSS
SCHEMBL5288135 0.81 TYR (0.58) ITGB3ITGAVCTSLCTSBCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0658169-A1 DIAMINO ACID DERIVATIVES AS ANTIHYPERTENSIVES SCHERING CORPORATION (US) 1995-06-21 EP disclosed
US-5298492-A Inhibitors of endopeptidase and treatment of cardiovascular disorders SCHERING CORPORATION (US) 1994-03-29 US disclosed
WO-1994003481-A1 DIAMINO ACID DERIVATIVES AS ANTIHYPERTENSIVES SCHERING CORPORATION (US) 1994-02-17 WO disclosed