SCHEMBL13819481

SCHEMBL13819481

CC(C)OC(Cc1cccc(-c2ccc(Cl)cc2Cl)c1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SHMT1 P34896 1/20 0.51
SHMT2 P34897 1/20 0.51
PPARA Q07869 16/20 0.50
PPARG P37231 14/20 0.46
PPARD Q03181 2/20 0.46
FFAR1 O14842 1/20 0.44
BCL2L1 Q07817 1/20 0.41
MCL1 Q07820 1/20 0.41
PTGER1 P34995 1/20 0.41

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
SCHEMBL13819721 0.85 PPARG (0.55) SHMT1SHMT2PPARAPPARGPPARD
SCHEMBL6650974 0.82 PPARA (0.45) PPARAPPARGPPARDFFAR1
SCHEMBL13819476 0.82 PPARG (0.52) PPARAPPARGPPARD
SCHEMBL6720420 0.81 PPARA (0.44) PPARAPPARGPPARDFFAR1
SCHEMBL6653525 0.81 PPARA (0.44) PPARAPPARGPPARDFFAR1
SCHEMBL13819716 0.80 MRGPRX4 (0.59) PPARAPPARG
SCHEMBL13819776 0.80 MRGPRX4 (0.59) PPARAPPARG
SCHEMBL13819768 0.79 PPARA (0.47) PPARAPPARGPPARDFFAR1
SCHEMBL13819821 0.78 NR4A2 (0.57) PPARAPPARGPPARD
SCHEMBL13819373 0.78 NR4A2 (0.57) PPARAPPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed