SCHEMBL6969292

SCHEMBL6969292

COc1cc(CCCC2SC(=O)NC2=O)ccc1OCc1coc(C=Cc2ccccc2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.42
PPARG P37231 1/20 0.42
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MTNR1A P48039 2/20 0.37
MTNR1B P49286 2/20 0.37
MAPT P10636 3/20 0.36
HPGD P15428 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 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
SCHEMBL6975086 1.00 PTPN1 (0.42) PTPN1PPARGMEN1KMT2AMTNR1A
SCHEMBL6968711 0.92 PTPN1 (0.37) PTPN1PPARGMEN1KMT2AMAPT
SCHEMBL6969220 0.86 PTPN1 (0.44) PTPN1PPARGMEN1KMT2AMTNR1A
SCHEMBL6584259 0.85 PPARG (0.58) PPARGMEN1KMT2AMTNR1AMTNR1B
SCHEMBL6584250 0.85 PPARG (0.58) PPARGMEN1KMT2AMTNR1AMTNR1B
SCHEMBL8888759 0.85 PTPN1 (0.42) PTPN1PPARGMEN1KMT2AMTNR1A
SCHEMBL6973327 0.85 PTPN1 (0.42) PTPN1PPARGMEN1KMT2AMTNR1A
SCHEMBL6973190 0.85 PTPN1 (0.43) PTPN1PPARGMEN1KMT2AMTNR1A
SCHEMBL6975089 0.85 PPARG (0.39) PTPN1PPARGMEN1KMT2AMTNR1A
SCHEMBL6584254 0.84 PPARG (0.41) PPARGMEN1KMT2AMTNR1AMTNR1B

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
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
WO-1997000249-A1 HETEROCYCLIC COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-01-03 WO disclosed