SCHEMBL8792886

SCHEMBL8792886

C[C@H](N)C(=O)N1CCC(CC(=O)O)CC1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 11/20 0.52
ITGA2B P08514 11/20 0.52
ANPEP P15144 1/20 0.44
ENPEP Q07075 1/20 0.44
DPP8 Q6V1X1 1/20 0.41
DPP7 Q9UHL4 1/20 0.41

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
SCHEMBL8792779 1.00 ITGB3 (0.52) ITGB3ITGA2BANPEPENPEPDPP8
SCHEMBL23188105 0.86 ITGB3 (0.51) ITGB3ITGA2B
SCHEMBL3930489 0.77 LMNA (0.47) DPP8DPP7
SCHEMBL2422675 0.76 EPHX2 (0.42) ITGB3ITGA2B
SCHEMBL6179700 0.76 ITGB3 (0.45) ITGB3ITGA2BANPEPENPEP
SCHEMBL30364025 0.76 SMYD3 (0.52) DPP8DPP7
SCHEMBL22629569 0.76 ALDH1A1 (0.66) DPP8DPP7
SCHEMBL15029445 0.76 MAPT (0.48)
SCHEMBL6435636 0.76 ITGB3 (0.55) ITGB3ITGA2B
SCHEMBL6435644 0.76 ITGB3 (0.55) ITGB3ITGA2B

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
EP-0800516-A1 FIBRINOGEN RECEPTOR ANTAGONISTS HAVING SUBSTITUTED (b)-AMINO ACID RESIDUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME NIPPON STEEL CORPORATION (JP) 1997-10-15 EP disclosed