SCHEMBL9197017

SCHEMBL9197017

NC(=O)[C@@H]1[C@H](Cc2ccccc2CCC(=O)O)[C@H]2CC[C@@H]1O2

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 19/20 0.53

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
SCHEMBL9200331 0.90 TBXA2R (0.52) TBXA2R
SCHEMBL10437533 0.90 TBXA2R (0.55) TBXA2R
SCHEMBL9201397 0.90 TBXA2R (0.55) TBXA2R
SCHEMBL14415447 0.85 TBXA2R (0.41) TBXA2R
SCHEMBL9195953 0.83 TBXA2R (0.59) TBXA2R
SCHEMBL9718067 0.80 TBXA2R (0.47) TBXA2R
SCHEMBL9203872 0.79 TBXA2R (0.53) TBXA2R
SCHEMBL8870983 0.77 TBXA2R (0.47) TBXA2R
SCHEMBL9698532 0.77 TBXA2R (0.54) TBXA2R
SCHEMBL8870972 0.77 TBXA2R (0.47) TBXA2R

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-0391652-B1 Interphenylène 7-oxabicycloheptyl substituted heterocyclic amide prostaglandin analogs useful in the treatment of thrombotic and vasopastic disease SQUIBB & SONS INC (US) 1995-03-15 EP disclosed
US-5153327-A 7-Oxabicycloheptyl substituted heterocyclic amide or ester prostaglandin analogs useful in the treatment of thrombotic and vasospastic disease E. R. SQUIBB & SONS, INC. (US) 1992-10-06 US disclosed
US-5100889-A Thromboxane A2 receptor antagonists, thromboxane synthetase inhibitor E. R. SQUIBB & SONS, INC. (US) 1992-03-31 US disclosed