SCHEMBL10942736

SCHEMBL10942736

O=C(O)CCS(=O)(=O)CCC(=O)N1C(c2ccc([N+](=O)[O-])cc2)SC[C@H]1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ ACE P12821 2/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HSD17B10 Q99714 1/20 0.38
▸ MMP2 P08253 1/20 0.37
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL10941388 0.86 POLB (0.43) POLBGAARAB9AACEALDH1A1
SCHEMBL10942643 0.86 POLB (0.43) POLBGAARAB9AACEALDH1A1
SCHEMBL11000518 0.86 POLB (0.43) POLBGAARAB9AACEALDH1A1
SCHEMBL10944637 0.83 POLB (0.43) POLBGAARAB9AACEALDH1A1
SCHEMBL10942993 0.75 L3MBTL1 (0.44) POLBACEALDH1A1KMT2ASMN1; SMN2
SCHEMBL10944246 0.75 L3MBTL1 (0.44) POLBACEALDH1A1KMT2ASMN1; SMN2
SCHEMBL10939993 0.74 ACE (0.57) POLBGAARAB9AACEALDH1A1
SCHEMBL10942943 0.73 L3MBTL1 (0.43) POLBACEALDH1A1HSD17B10KMT2A
SCHEMBL10942665 0.73 SMN1; SMN2 (0.45) POLBACEALDH1A1HSD17B10KMT2A
SCHEMBL4316372 0.72 POLB (0.49) POLBGAARAB9AALDH1A1MAPT

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-0031104-B1 THIAZOLIDINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANTEN PHARMACEUTICAL CO., LTD. (JP) 1985-10-23 — — EP disclosed
US-4499102-A HYPOTENSIVE AND ANTIDIABETIC AGENTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1985-02-12 — — US disclosed
EP-0031104-A1 Thiazolidine compounds, processes for their preparation and pharmaceutical compositions containing them SANTEN PHARMACEUTICAL CO., LTD. (JP) 1981-07-01 — — EP disclosed
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