SCHEMBL9024338

SCHEMBL9024338

O=C(O)CCCC=C[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)CN1CCCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTGDR Q13258 8/20 0.48
▸ TBXA2R P21731 7/20 0.45
▸ TBXAS1 P24557 5/20 0.44
▸ HTT P42858 1/20 0.43
▸ PTGIR P43119 1/20 0.42

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
SCHEMBL9006279 1.00 PTGDR (0.48) PTGDRTBXA2RTBXAS1HTTPTGIR
SCHEMBL9006184 0.97 PTGDR (0.47) PTGDRTBXA2RTBXAS1HTTPTGIR
SCHEMBL9025339 0.97 PTGDR (0.47) PTGDRTBXA2RTBXAS1HTTPTGIR
SCHEMBL9024374 0.97 PTGDR (0.47) PTGDRTBXA2RTBXAS1HTTPTGIR
SCHEMBL9006079 0.97 PTGDR (0.47) PTGDRTBXA2RTBXAS1HTTPTGIR
SCHEMBL9006113 0.97 PTGDR (0.49) PTGDRTBXA2RTBXAS1HTTPTGIR
SCHEMBL9024290 0.97 PTGDR (0.49) PTGDRTBXA2RTBXAS1HTTPTGIR
SCHEMBL9023689 0.92 TBXA2R (0.44) PTGDRTBXA2RTBXAS1HTT
SCHEMBL9006228 0.92 TBXA2R (0.44) PTGDRTBXA2RTBXAS1HTT
SCHEMBL9025167 0.91 TBXA2R (0.48) PTGDRTBXA2RTBXAS1HTTPTGIR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0367130-B1 Pyrrolidine derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1996-10-02 — — EP disclosed
US-5264453-A Pyrrolidine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-11-23 — — US disclosed
US-5130323-A PYRROLIDINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-14 — — US disclosed
EP-0367130-A2 Pyrrolidine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-05-09 — — EP disclosed
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