SCHEMBL11761982

SCHEMBL11761982

CCCCCCCCCCCCCCCCCCSCCCc1ccc(C(=O)O)c(C(=O)O)c1CCCSCCCCCCCCCCCCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 5/20 0.44
BID P55957 3/20 0.44
MCL1 Q07820 3/20 0.44
PPARG P37231 3/20 0.44
BCL2L1 Q07817 2/20 0.44
BAK1 Q16611 2/20 0.44
KAT8 Q9H7Z6 2/20 0.44
SAE1 Q9UBE0 2/20 0.44
EP300 Q09472 1/20 0.44
KAT2A Q92830 1/20 0.44
KAT2B Q92831 1/20 0.44
KAT5 Q92993 1/20 0.44
PLA2G4B P0C869 1/20 0.41
RARB P10826 1/20 0.40
MAPT P10636 2/20 0.40
HSD17B10 Q99714 2/20 0.40
GMNN O75496 1/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL11759962 1.00 PPARA (0.44) PPARABIDMCL1PPARGBCL2L1
SCHEMBL11764497 0.99 PPARA (0.43) PPARABIDMCL1PPARGBCL2L1
SCHEMBL11762460 0.95 BID (0.40) PPARABIDMCL1PPARGBCL2L1
SCHEMBL11760507 0.92 PPARA (0.37) PPARABIDMCL1PPARGBCL2L1
SCHEMBL10831730 0.89 PPARA (0.54) PPARABIDMCL1PPARGBCL2L1
SCHEMBL11036941 0.89 PPARA (0.54) PPARABIDMCL1PPARGBCL2L1
SCHEMBL183977 0.89 PPARA (0.54) PPARABIDMCL1PPARGBCL2L1
SCHEMBL10831711 0.89 PPARA (0.54) PPARABIDMCL1PPARGBCL2L1
SCHEMBL10831673 0.89 PPARA (0.54) PPARABIDMCL1PPARGBCL2L1
SCHEMBL10832420 0.89 PPARA (0.54) PPARABIDMCL1PPARGBCL2L1

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-4035337-A ALKYLTHIO ALKYL PHTHALATES ARMSTRONG CORK COMPANY (US) 1977-07-12 US disclosed