SCHEMBL9792067

SCHEMBL9792067

Cc1ccc(S(=O)(=O)N[C@H]2[C@H]3CC[C@H](C3)[C@@H]2C=CCCCC(=O)O)cc1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PTGDR Q13258 17/20 0.61
▸ TBXA2R P21731 8/20 0.61
▸ PTGIR P43119 2/20 0.60

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
SCHEMBL9792051 1.00 PTGDR (0.61) PTGDRTBXA2RPTGIR
SCHEMBL9792057 1.00 PTGDR (0.61) PTGDRTBXA2RPTGIR
SCHEMBL9792063 1.00 PTGDR (0.61) PTGDRTBXA2RPTGIR
SCHEMBL9792095 0.91 TBXA2R (0.62) PTGDRTBXA2RPTGIR
SCHEMBL9792075 0.91 TBXA2R (0.62) PTGDRTBXA2RPTGIR
SCHEMBL9792081 0.91 TBXA2R (0.62) PTGDRTBXA2RPTGIR
SCHEMBL9792090 0.91 TBXA2R (0.62) PTGDRTBXA2RPTGIR
SCHEMBL9792043 0.91 TBXA2R (0.74) PTGDRTBXA2RPTGIR
SCHEMBL9792052 0.91 TBXA2R (0.74) PTGDRTBXA2RPTGIR
SCHEMBL9792037 0.91 TBXA2R (0.74) PTGDRTBXA2RPTGIR

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
US-5002972-A Compound and composition of substituted hexenoic acid derivatives useful for treating thromboxane A2 mediated diseases SHIONOGI & CO., LTD. (JP) 1991-03-26 — — US disclosed
EP-0384747-A1 Pharmaceutical or veterinary preparations of substituted hexenoic acid derivatives SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1990-08-29 — — EP disclosed
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