SCHEMBL9006196

SCHEMBL9006196

CC(C)(C)OC(=O)N1C[C@H](NS(=O)(=O)c2ccc(Cl)cc2)C[C@H]1C=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STS P08842 5/20 0.52
▸ NR1H2 P55055 1/20 0.47
▸ TBXA2R P21731 3/20 0.43
▸ HTT P42858 1/20 0.41
▸ HDAC8 Q9BY41 2/20 0.41
▸ HRH2 P25021 2/20 0.41
▸ APP P05067 1/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ DRD2 P14416 1/20 0.41
▸ ADRA2B P18089 1/20 0.41
▸ ADRA2C P18825 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ HTR1D P28221 1/20 0.41
▸ HTR1B P28222 1/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ HTR2C P28335 1/20 0.41
▸ HTR7 P34969 1/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ OPRK1 P41145 1/20 0.41

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
SCHEMBL9504084 0.91 NR1H2 (0.46) STSNR1H2HRH2HSD11B1MCL1
SCHEMBL10701160 0.89 NR1H2 (0.46) NR1H2MCL1
SCHEMBL9503238 0.89 NR1H2 (0.46) NR1H2MCL1
SCHEMBL9507014 0.89 NR1H2 (0.46) NR1H2MCL1
SCHEMBL9506352 0.89 STS (0.53) STSNR1H2HRH2HRH1
SCHEMBL9506263 0.88 NR1H2 (0.48) STSNR1H2HSD11B1F13A1TGM2
SCHEMBL9024050 0.86 TBXA2R (0.47) STSNR1H2TBXA2RHTTMCL1
SCHEMBL9503235 0.86 STS (0.45) STSNR1H2TBXA2RHTTHSD11B1
SCHEMBL9006203 0.86 TBXA2R (0.47) STSNR1H2TBXA2RHTTMCL1
SCHEMBL9503241 0.86 STS (0.45) STSNR1H2TBXA2RHTTHSD11B1

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 8 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-5514701-A Pyrrolidine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-07 — — US disclosed
US-5264453-A Pyrrolidine derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-11-23 — — US disclosed
EP-0289911-B1 PYRROLIDINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-16 — — EP 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
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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