SCHEMBL8934968

SCHEMBL8934968

CCCCCCCCCCCCCCCCOC[C@H](O)COP(=O)(Oc1ccc(C[C@H](N)C(=O)O)cc1)OP(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY10 O00398 16/20 0.52
GPR174 Q9BXC1 13/20 0.51
LPAR5 Q9H1C0 1/20 0.49
GPR34 Q9UPC5 6/20 0.44
ITGB3 P05106 1/20 0.43
ITGA2B P08514 1/20 0.43

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
SCHEMBL8934963 0.89 P2RY10 (0.60) P2RY10GPR174LPAR5GPR34
SCHEMBL8935189 0.88 P2RY10 (0.58) P2RY10GPR174LPAR5GPR34
SCHEMBL8693317 0.85 ITGB3 (0.43) P2RY10GPR174ITGB3ITGA2B
SCHEMBL560103 0.78 ITGB3 (0.51) P2RY10GPR174ITGB3ITGA2B
SCHEMBL8692789 0.77 ITGB3 (0.47) P2RY10GPR174GPR34ITGB3ITGA2B
SCHEMBL8697384 0.76 P2RY10 (0.45) P2RY10GPR174GPR34ITGB3ITGA2B
SCHEMBL8934961 0.75 LPAR5 (0.57) P2RY10GPR174LPAR5GPR34
Serine SCHEMBL28305481 0.74 LPAR5 (0.73) P2RY10GPR174LPAR5GPR34
SCHEMBL28863962 0.73 P2RY10 (0.87) P2RY10GPR174LPAR5GPR34
SCHEMBL30778404 0.73 P2RY10 (0.87) P2RY10GPR174LPAR5GPR34

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-0596024-A4 LIPID CONJUGATES OF THERAPEUTIC PEPTIDES AND PROTEASE INHIBITORS. VESTAR INC (US) 1996-07-17 EP disclosed
EP-0596024-A1 LIPID CONJUGATES OF THERAPEUTIC PEPTIDES AND PROTEASE INHIBITORS NeXstar Pharmaceuticals, Inc. (US) 1994-05-11 EP disclosed
WO-1993001828-A1 LIPID CONJUGATES OF THERAPEUTIC PEPTIDES AND PROTEASE INHIBITORS VICAL, INC. (US) 1993-02-04 WO disclosed