SCHEMBL6969226

SCHEMBL6969226

COc1cc(CCCC2NC(=O)SC2=O)ccc1OCc1coc(-c2ccccc2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.41
PPARG P37231 5/20 0.40
MTNR1A P48039 2/20 0.39
MTNR1B P49286 2/20 0.39
PPARA Q07869 5/20 0.39
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
HSD17B10 Q99714 2/20 0.35
KDM4C Q9H3R0 1/20 0.35
APP P05067 1/20 0.35
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
S1PR4 O95977 1/20 0.34
S1PR1 P21453 1/20 0.34
S1PR5 Q9H228 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
SCHEMBL8340545 0.88 MTNR1A (0.41) PPARGMTNR1AMTNR1BMEN1KMT2A
SCHEMBL6585594 0.86 PPARG (0.42) FFAR1PPARGMTNR1AMTNR1BPPARA
SCHEMBL6975089 0.86 PPARG (0.39) PPARGMTNR1AMTNR1BMEN1KMT2A
SCHEMBL6967428 0.85 ALDH1A1 (0.43) MTNR1AMTNR1BPPARAMEN1KMT2A
SCHEMBL4727181 0.85 PPARG (0.54) FFAR1PPARGMTNR1AMTNR1BPPARA
SCHEMBL6969220 0.84 PTPN1 (0.44) FFAR1PPARGMTNR1AMTNR1BPPARA
SCHEMBL6585583 0.81 PPARG (0.61) FFAR1PPARGMTNR1AMTNR1BPPARA
SCHEMBL8341338 0.81 PPARG (0.41) PPARGMTNR1AMTNR1BPPARAMEN1
SCHEMBL8339459 0.80 HDAC1 (0.43) PPARGMTNR1AMTNR1BMEN1KMT2A
SCHEMBL6583405 0.79 FFAR1 (0.41) FFAR1PPARGPPARASMN1; SMN2LMNA

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