SCHEMBL8523889

SCHEMBL8523889

O=C1SC(OCCC2OCCO2)C(=O)N1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
MAPT P10636 5/20 0.41
THRB P10828 2/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
ALDH1A1 P00352 8/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 2/20 0.39
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
STAT6 P42226 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
F2 P00734 1/20 0.36

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
SCHEMBL3774754 0.78 MAPT (0.50) POLBMAPTTHRBGSK3AGSK3B
SCHEMBL6032173 0.77 MAPT (0.54) POLBMAPTTHRBGSK3AGSK3B
SCHEMBL7469304 0.74 POLB (0.55) POLBMAPTTHRBGSK3AGSK3B
SCHEMBL8687366 0.73 POLB (0.44) POLBMAPTTHRBALDH1A1MEN1
SCHEMBL8523856 0.72 ALDH1A1 (0.44) POLBMAPTTHRBALDH1A1MEN1
SCHEMBL8575184 0.72 POLB (0.38) POLBMAPTTHRBGSK3AGSK3B
SCHEMBL8576735 0.71 POLB (0.38) POLBMAPTTHRBALDH1A1MEN1
SCHEMBL8524317 0.71 FFAR1 (0.44) POLBMAPTTHRBKMT2AGAA
SCHEMBL8440670 0.71 PPARG (0.46) CYP3A4CYP2C9
SCHEMBL8472017 0.71 POLB (0.45) POLBMAPTTHRBALDH1A1MEN1

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
US-5739345-A HYPOGLYCEMIC AND ANTIDIABETIC AGENTS SANKYO COMPANY, LIMITED (JP) 1998-04-14 US claimed
US-5962470-A Heterocyclic compounds having anti-diabetic activity and their use SANKYO COMPANY, LIMITED (JP) 1999-10-05 US disclosed
US-5834501-A TREATING DIABETES OR HYPERLIPEMIA SANKYO COMPANY, LIMITED (JP) 1998-11-10 US disclosed
US-5739345-A HYPOGLYCEMIC AND ANTIDIABETIC AGENTS SANKYO COMPANY, LIMITED (JP) 1998-04-14 US disclosed