SCHEMBL7050867

SCHEMBL7050867

O=C(O)COc1cccc2c1CC[C@](O)(COC(=O)N(c1ccc(F)cc1)c1ccccc1F)C2

nearest known ligand 0.77

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 18/20 0.77
PTGDR Q13258 7/20 0.77
PTGER1 P34995 1/20 0.77
PTGER3 P43115 1/20 0.77
AGTR2 P50052 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36

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
SCHEMBL7049759 0.94 PTGIR (0.77) PTGIRPTGDRPTGER1PTGER3PTGDR2
SCHEMBL7050827 0.92 PTGIR (0.91) PTGIRPTGDRPTGER1PTGER3PTGDR2
SCHEMBL7050802 0.92 PTGIR (0.87) PTGIRPTGDRPTGER1PTGER3PTGDR2
SCHEMBL7051528 0.90 PTGIR (0.62) PTGIRPTGDRPTGER1PTGER3AGTR2
SCHEMBL7778677 0.87 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3
SCHEMBL29760759 0.87 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3
SCHEMBL6612991 0.87 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3
SCHEMBL6612986 0.87 PTGIR (1.00) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7052341 0.87 PTGIR (0.81) PTGIRPTGDRPTGER1PTGER3
SCHEMBL7051509 0.85 PTGIR (0.91) PTGIRPTGDRPTGER1PTGER3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042277-B1 NAPHTHALENE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2003-04-23 EP disclosed
US-6303649-B1 FOR THERAPY AND PROPHYLAXIS OF ARTERIAL OBSTRUCTION, CEREBROVASCULAR DISEASE, HEPATIC CIRRHOSIS, ARTERIOSCLEROSIS, ISCHEMIC HEART DISEASE, RESTENOSIS, ISCHEMIC COMPLICATIONS AFTER CORONARY ANGIOPLASTY, HYPERTENSION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-16 US disclosed