SCHEMBL6949208

SCHEMBL6949208

CCOC(Cc1ccc(OCCn2c(=O)sc3ccccc3c2=O)cc1)C(=O)OC

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.56
PPARG P37231 14/20 0.56
PPARD Q03181 1/20 0.56
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NPC1 O15118 1/20 0.46
LMNA P02545 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL6950369 0.91 PPARA (0.69) PPARAPPARGPPARD
SCHEMBL6950311 0.90 PPARA (0.60) PPARAPPARGPPARDTDP1L3MBTL1
SCHEMBL6952264 0.81 PPARG (0.48) PPARAPPARGPPARDTDP1L3MBTL1
SCHEMBL5892209 0.81 PPARG (0.80) PPARAPPARGPPARD
SCHEMBL6949251 0.80 L3MBTL1 (0.46) PPARAPPARGPPARDTDP1L3MBTL1
SCHEMBL5427011 0.80 PPARG (0.66) PPARAPPARGPPARD
SCHEMBL5427010 0.80 PPARG (0.66) PPARAPPARGPPARD
SCHEMBL5892314 0.79 PPARG (0.65) PPARAPPARG
SCHEMBL5416637 0.79 PPARG (0.65) PPARAPPARG
SCHEMBL5416633 0.79 PPARG (0.65) PPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0903343-B1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP CO LTD (JP) 2003-05-28 EP disclosed
EP-0903343-A1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP Co., Ltd. (JP) 1999-03-24 EP disclosed