SCHEMBL7400796

SCHEMBL7400796

CCCCS(=O)(=O)NC(Cc1ccc(OC2CCN(c3ccncc3)CC2)cc1)C(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 12/20 0.51
ITGA2B P08514 12/20 0.51
ITGAV P06756 1/20 0.45
CHRM2 P08172 1/20 0.45
SLC6A4 P31645 1/20 0.45
NAMPT P43490 2/20 0.42
ACACB O00763 4/20 0.40
FFAR4 Q5NUL3 1/20 0.38
F10 P00742 1/20 0.38

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
SCHEMBL7400140 0.93 ITGB3 (0.57) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7402982 0.88 ITGB3 (0.50) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7402980 0.88 ITGB3 (0.50) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL8604265 0.87 ITGB3 (0.56) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL8603352 0.87 ITGB3 (0.58) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7404620 0.86 ITGB3 (0.62) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL9409440 0.85 ITGB3 (0.56) ITGB3ITGA2BF10
SCHEMBL7395334 0.81 ITGB3 (0.57) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7400250 0.81 ITGB3 (0.49) ITGB3ITGA2BITGAVCHRM2SLC6A4
SCHEMBL7395332 0.81 ITGB3 (0.57) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0691959-B1 HETEROCYCLIC DERIVATIVES AS PLATELET AGGREGATION INHIBITORS ZENECA LTD (GB) 1998-07-22 EP disclosed
US-5652242-A 3-METHYL-4-(4-(4-(4-PYRIDYL)PIPERAZIN-1-YL)PHENOXY)BURYIC ACID, AMIDE OR ESTER; INHIBITORS OF BINDING OF FIBRINOGEN TO GLYCOPROTEIN ZENECA LIMITED (GB) 1997-07-29 US disclosed
US-5563141-A INHIBIT CELL ADHESION FOR EXAMPLE, PLATELET AGGRE GATION ZENECA LIMITED (GB) 1996-10-08 US disclosed
US-5556977-A ANTIAGGLOMERANTS FOR CELLS, ANTICOAGULANTS, ANTIISCHEMIC AGENTS USING PYRIDINYLPIPERAZINE DERIVATIVES ZENECA LIMITED (GB) 1996-09-17 US disclosed
EP-0690847-A1 HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS ZENECA LIMITED (GB) 1996-01-10 EP disclosed
WO-1994022835-A2 HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS ZENECA LIMITED (GB) 1994-10-13 WO disclosed