SCHEMBL6971349

SCHEMBL6971349

COc1cc(C=CC=C2SC(=O)NC2=O)ccc1OCc1coc(-c2ccccc2)n1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
IGF1R P08069 1/20 0.46
CISD1 Q9NZ45 1/20 0.45
MGAM O43451 1/20 0.44
GAA P10253 1/20 0.44
SI P14410 1/20 0.44
MGAM2 Q2M2H8 1/20 0.44
HPGD P15428 6/20 0.43
PIM1 P11309 1/20 0.43
PDE4B Q07343 1/20 0.43
PIM3 Q86V86 1/20 0.43
PIM2 Q9P1W9 1/20 0.43
PTPN1 P18031 2/20 0.42
KCNH2 Q12809 1/20 0.42
PTP4A3 O75365 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
SCHEMBL6971353 0.90 MEN1 (0.44) MEN1KMT2AIGF1RCISD1MGAM
SCHEMBL6581248 0.85 KMT2A (0.39) MEN1KMT2ACISD1HPGD
SCHEMBL6581254 0.84 ALDH1A1 (0.37) MEN1KMT2AHPGD
SCHEMBL6960790 0.84 MEN1 (0.58) MEN1KMT2AIGF1RCISD1MGAM
SCHEMBL6582223 0.83 TRPA1 (0.48) HPGD
SCHEMBL6582227 0.83 TRPA1 (0.48) HPGD
SCHEMBL6586658 0.79 ALDH1A1 (0.52) MEN1KMT2AHPGD
SCHEMBL8482892 0.79 CA2 (0.57) HPGD
SCHEMBL8482890 0.79 CA2 (0.57) HPGD
SCHEMBL6583463 0.78 PTGS1 (0.44) HPGD

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