SCHEMBL11065494

SCHEMBL11065494

O=C(O)C=CCCCc1ccc(Cc2cccnc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 18/20 0.64
GPR52 Q9Y2T5 1/20 0.52

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
SCHEMBL11065492 1.00 TBXAS1 (0.64) TBXAS1GPR52
SCHEMBL11061732 0.96 TBXAS1 (0.62) TBXAS1GPR52
SCHEMBL11061737 0.96 TBXAS1 (0.62) TBXAS1GPR52
SCHEMBL11062791 0.92 TBXAS1 (0.67) TBXAS1GPR52
SCHEMBL11062795 0.92 TBXAS1 (0.67) TBXAS1GPR52
SCHEMBL11068160 0.83 TBXAS1 (0.70) TBXAS1GPR52
SCHEMBL10456551 0.83 TBXAS1 (0.70) TBXAS1GPR52
Hydrochloric Acid SCHEMBL10456547 0.82 TBXAS1 (0.71) TBXAS1
SCHEMBL8514462 0.82 GPR52 (0.65) TBXAS1GPR52
SCHEMBL8514458 0.82 GPR52 (0.65) TBXAS1GPR52

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
US-4427682-A ANTICOAGULANTS, ANTIINFLAMMATORY, HYPOTENSIVE, OR ANTIALLERGEN AGENTS ONO PHARMACEUTICAL CO., LTD. (JP) 1984-01-24 US disclosed
US-4317828-A ANTIINFLAMMATORY AGENTS, HYPOTENSIVE AGENTS ONO PHARMACEUTICAL CO., LTD. (JP) 1982-03-02 US disclosed
US-4271170-A THROMBOXANE SYNTHETASE ENZYME INHIBITOR USEFUL IN TREATING INFLAMMATION, HYPERTENSION, THROMBUS, CEREBRAL APOPLEXY, ASTHMA, AND CARDIOVASCULAR DISORDERS ONO PHARMACEUTICAL CO., LTD., (JP) 1981-06-02 US disclosed