SCHEMBL10492250

SCHEMBL10492250

O=C(O)CN1C(=O)C(=Cc2ccccc2C(=O)O)SC1=S

nearest known ligand 0.76

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTPN12 Q05209 1/20 0.62
▸ PTPN22 Q9Y2R2 1/20 0.62
▸ MMP3 P08254 1/20 0.61
▸ AKR1B1 P15121 1/20 0.61
▸ PTPN1 P18031 1/20 0.61
▸ MMP13 P45452 1/20 0.61
▸ MEN1 O00255 4/20 0.61
▸ KMT2A Q03164 4/20 0.61
▸ POLB P06746 3/20 0.61
▸ ALDH1A1 P00352 1/20 0.59
▸ MAPT P10636 1/20 0.59

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
SCHEMBL10492244 1.00 PTPN12 (0.62) PTPN12PTPN22MMP3AKR1B1PTPN1
SCHEMBL12008575 0.88 CISD1 (0.72) AKR1B1PTPN1MEN1KMT2APOLB
SCHEMBL8188134 0.87 AKR1B1 (0.70) AKR1B1MAPT
SCHEMBL10492194 0.86 MMP3 (0.62) PTPN12PTPN22MMP3AKR1B1PTPN1
SCHEMBL10492197 0.86 MMP3 (0.62) PTPN12PTPN22MMP3AKR1B1PTPN1
SCHEMBL12008568 0.86 POLB (0.68) MEN1KMT2APOLBALDH1A1MAPT
SCHEMBL13401679 0.85 MEN1 (0.57) MEN1KMT2APOLBALDH1A1MAPT
SCHEMBL10492318 0.85 POLB (0.66) MEN1KMT2APOLBALDH1A1MAPT
SCHEMBL10492321 0.85 POLB (0.66) MEN1KMT2APOLBALDH1A1MAPT
SCHEMBL10492272 0.83 AKR1B1 (0.78) MMP3AKR1B1PTPN1MMP13MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0047109-B1 RHODANINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND ALDOSE REDUCTASE INHIBITOR CONTAINING THE RHODANINE DERIVATIVES AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1985-01-02 — — EP claimed
EP-0047109-A1 Rhodanine derivatives, process for their preparation, and aldose reductase inhibitor containing the rhodanine derivatives as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 1982-03-10 — — EP claimed
US-4831045-A Rhodanine derivatives, process for their preparation, and aldose reductase inhibitor containing the rhodanine derivatives as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 1989-05-16 — — US disclosed
US-4791126-A Rhodanine derivatives, process for their preparation, and aldose reductase inhibitor containing the rhodanine derivatives as active ingredients ONO PHARMACEUTICAL CO., LTD. (JP) 1988-12-13 — — US disclosed
EP-0047109-B1 RHODANINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND ALDOSE REDUCTASE INHIBITOR CONTAINING THE RHODANINE DERIVATIVES AS ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1985-01-02 — — EP disclosed
US-4464382-A Rhodanine derivatives, process for their preparation, and aldose reductase inhibitor containing the rhodanine derivatives as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 1984-08-07 — — US disclosed
EP-0047109-A1 Rhodanine derivatives, process for their preparation, and aldose reductase inhibitor containing the rhodanine derivatives as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 1982-03-10 — — EP disclosed
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