SCHEMBL6973500

SCHEMBL6973500

O=C1NC(=O)C(CCc2ccc(O)cc2)S1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.51
MAOA P21397 2/20 0.49
CISD1 Q9NZ45 2/20 0.49
MAOB P27338 1/20 0.49
PPARG P37231 5/20 0.46
FFAR1 O14842 3/20 0.45
PPARA Q07869 2/20 0.45
ALDH1A1 P00352 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
KDM4E B2RXH2 2/20 0.43
TSHR P16473 2/20 0.43
HTT P42858 1/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
SLC6A2 P23975 2/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTR3A P46098 1/20 0.41
BACE1 P56817 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
SCHEMBL8889930 0.90 MAPT (0.49) MAPTMAOACISD1MAOBPPARG
SCHEMBL8899380 0.89 MAPT (0.48) MAPTMAOACISD1MAOBPPARG
SCHEMBL8172864 0.85 MAOA (0.54) MAPTMAOACISD1MAOBPPARG
Glitazone SCHEMBL623021 0.83 MAPT (0.73) MAPTMAOACISD1MAOBPPARG
SCHEMBL6959460 0.78 GLA (0.47) MAPTPPARGFFAR1PPARAALDH1A1
SCHEMBL19217794 0.77 FFAR1 (0.56) MAOAMAOBPPARGFFAR1PPARA
SCHEMBL8208034 0.75 PPARG (0.51) MAPTMAOACISD1MAOBPPARG
SCHEMBL8840901 0.75 TSHR (0.61) MAPTMAOACISD1MAOBPPARG
SCHEMBL9570559 0.74 MAPT (0.83) MAPTMAOACISD1MAOBPPARG
SCHEMBL8981836 0.73 MAPT (0.79) MAPTMAOACISD1MAOBPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783496-B9 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-09-03 EP disclosed
EP-0783496-B1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-03-26 EP disclosed
US-5965589-A AN ACTIVE MATERIAL HAVING HYPOGLYCEMIC ACTIVITY AND BLOOD LIPID LOWERING ACTIVITY, FOR USE AS AN ANTIDIABETIC AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-12 US disclosed
EP-0783496-A1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-07-16 EP disclosed
WO-1996005186-A1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-22 WO disclosed