SCHEMBL6202351

SCHEMBL6202351

CCOCOCCCc1ccc(OCCc2nc(-c3cccs3)oc2C)cc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.63
PPARA Q07869 15/20 0.63
PPARD Q03181 7/20 0.57
KDM4E B2RXH2 2/20 0.45
MAPT P10636 1/20 0.43
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL4027981 0.94 PPARG (0.65) PPARGPPARAPPARDKDM4EMAPT
SCHEMBL4027979 0.85 PPARG (0.68) PPARGPPARAPPARDKDM4EMAPT
SCHEMBL4027996 0.82 PPARG (0.71) PPARGPPARAPPARDKDM4E
SCHEMBL12442798 0.81 PPARA (0.64) PPARGPPARAPPARDKDM4EMAPT
SCHEMBL6202684 0.81 PPARG (0.73) PPARGPPARAPPARD
SCHEMBL4029812 0.81 PPARG (0.70) PPARGPPARAPPARDKDM4E
SCHEMBL6202354 0.81 PPARG (0.67) PPARGPPARAPPARD
SCHEMBL4028994 0.80 PPARA (0.61) PPARGPPARAPPARDKDM4EMAPT
SCHEMBL6228947 0.80 PPARG (0.80) PPARGPPARAPPARD
SCHEMBL4029074 0.80 PPARG (0.68) PPARGPPARAPPARDKDM4E

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-1569916-A1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LTD. (IN) 2005-09-07 EP claimed
WO-2004046119-A1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2004-06-03 WO claimed
EP-1569916-A1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LTD. (IN) 2005-09-07 EP disclosed
WO-2004046119-A1 SUBSTITUTED ARALKYL DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2004-06-03 WO disclosed