SCHEMBL6505749

SCHEMBL6505749

CCC(Cc1ccc(OC)c(NC(=O)Cc2ccc(Cl)cc2Cl)c1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 14/20 0.64
PPARD Q03181 8/20 0.53
PPARG P37231 6/20 0.53
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.47
ALDH1A1 P00352 2/20 0.47

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
SCHEMBL6505410 0.88 PPARA (0.62) PPARAPPARDPPARG
SCHEMBL6504914 0.80 PPARA (0.52) PPARAPPARDPPARGMEN1KMT2A
SCHEMBL6066438 0.79 MEN1 (0.59) MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3944713 0.78 PPARA (0.72) PPARAPPARDPPARGALDH1A1
SCHEMBL3942737 0.78 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL3942730 0.78 PPARA (1.00) PPARAPPARDPPARG
SCHEMBL6066354 0.77 MEN1 (0.59) MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3947259 0.77 PPARA (0.72) PPARAPPARDPPARGSMN1; SMN2ALDH1A1
SCHEMBL6495887 0.75 PPARA (0.76) PPARAPPARDPPARG
SCHEMBL6494313 0.74 PPARA (0.65) PPARAPPARDPPARG

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
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed