SCHEMBL9503241

SCHEMBL9503241

CCOC(=O)C=C[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)CN1C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ STS P08842 2/20 0.45
▸ NR1H2 P55055 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ TSHR P16473 1/20 0.40
▸ POLB P06746 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CTSL P07711 1/20 0.38
▸ CTSB P07858 1/20 0.38
▸ CTSS P25774 1/20 0.38
▸ CTSK P43235 1/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ TBXA2R P21731 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ HSD11B1 P28845 1/20 0.37

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
SCHEMBL9503235 1.00 STS (0.45) STSNR1H2MEN1KMT2AMAPT
SCHEMBL9006196 0.86 STS (0.52) STSNR1H2HTTTBXA2RHSD11B1
SCHEMBL9503272 0.83 MMP2 (0.45) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL9503268 0.83 MMP2 (0.45) MEN1KMT2AMAPTKDM4EHTT
SCHEMBL9006203 0.82 TBXA2R (0.47) STSNR1H2HTTTBXA2R
SCHEMBL9024050 0.82 TBXA2R (0.47) STSNR1H2HTTTBXA2R
SCHEMBL9023890 0.81 TBXA2R (0.47) STSNR1H2TBXA2R
SCHEMBL9006258 0.81 TBXA2R (0.47) STSNR1H2TBXA2R
SCHEMBL9006155 0.79 STS (0.44) STSNR1H2MAPTLMNAHSD11B1
SCHEMBL9006149 0.79 STS (0.44) STSNR1H2MAPTLMNAHSD11B1

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-0289911-B1 PYRROLIDINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-16 — — EP disclosed
US-4916152-A THROMBOXANE A2 ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-04-10 — — US disclosed
EP-0289911-A2 Pyrrolidine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-11-09 — — EP disclosed
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