SCHEMBL6964371

SCHEMBL6964371

Cc1oc(-c2ccc3ccccc3c2)nc1COc1ccc(CCCCCOS(C)(=O)=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.52
PPARG P37231 12/20 0.47
PPARA Q07869 12/20 0.47
MAPT P10636 3/20 0.44
KDR P35968 1/20 0.43

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
SCHEMBL6972841 0.85 FFAR1 (0.58) FFAR1PPARGPPARAMAPTKDR
SCHEMBL5380575 0.83 FFAR1 (0.69) FFAR1PPARGPPARAKDR
SCHEMBL6965302 0.82 FFAR1 (0.52) FFAR1PPARGPPARAMAPTKDR
SCHEMBL6970759 0.81 FFAR1 (0.61) FFAR1PPARGPPARAMAPT
SCHEMBL6963887 0.80 FFAR1 (0.54) FFAR1PPARGPPARAMAPTKDR
SCHEMBL8845954 0.80 FFAR1 (0.50) FFAR1PPARGPPARAMAPTKDR
SCHEMBL4029049 0.78 KDR (0.64) FFAR1PPARGPPARAMAPTKDR
SCHEMBL7162113 0.78 FFAR1 (0.54) FFAR1PPARGPPARAMAPTKDR
SCHEMBL6203880 0.78 FFAR1 (0.59) FFAR1PPARGPPARA
SCHEMBL6957652 0.77 FFAR1 (0.51) FFAR1PPARGPPARAMAPTKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0629624-B1 Tetrazole derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-04-23 EP disclosed
US-5591862-A ANTILIPEMICS, TREATING DIABETES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-01-07 US disclosed
EP-0629624-A1 Tetrazole derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-12-21 EP disclosed