SCHEMBL7944628

SCHEMBL7944628

CCCCCCCCCCc1c(CCCCCCCCCC)c(CCCCCCCCCC)c(C(=O)O)c(C(=O)O)c1CC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 3/20 0.46
MCL1 Q07820 3/20 0.46
KAT8 Q9H7Z6 3/20 0.46
PPARA Q07869 3/20 0.46
BCL2L1 Q07817 2/20 0.46
BAK1 Q16611 2/20 0.46
PPARG P37231 2/20 0.46
EP300 Q09472 2/20 0.46
KAT5 Q92993 2/20 0.46
KAT2A Q92830 1/20 0.46
KAT2B Q92831 1/20 0.46
SAE1 Q9UBE0 1/20 0.46
GPR35 Q9HC97 5/20 0.42
SCD O00767 1/20 0.42
RARB P10826 4/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
RARA P10276 1/20 0.41
MAPT P10636 1/20 0.41
MTOR P42345 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
SCHEMBL23748542 0.94 BID (0.50) BIDMCL1KAT8PPARABCL2L1
SCHEMBL26622817 0.94 BID (0.50) BIDMCL1KAT8PPARABCL2L1
SCHEMBL29763191 0.94 BID (0.50) BIDMCL1KAT8PPARABCL2L1
SCHEMBL28856905 0.92 FFAR1 (0.40) BIDMCL1KAT8PPARABCL2L1
SCHEMBL14989227 0.92 BID (0.49) BIDMCL1KAT8PPARABCL2L1
SCHEMBL14989144 0.92 BID (0.49) BIDMCL1KAT8PPARABCL2L1
SCHEMBL14989126 0.92 BID (0.49) BIDMCL1KAT8PPARABCL2L1
SCHEMBL14989208 0.92 BID (0.49) BIDMCL1KAT8PPARABCL2L1
SCHEMBL8496979 0.92 BID (0.49) BIDMCL1KAT8PPARABCL2L1
SCHEMBL14989296 0.92 BID (0.49) BIDMCL1KAT8PPARABCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6200923-B1 AS POLYMERIZATION CATALYSTS BOREALIS TECHNOLOGY OY (FI) 2001-03-13 US disclosed
EP-0889915-A1 A NOVEL COMPOSITION, ITS PREPARATION AND USE BOREALIS A/S (DK) 1999-01-13 EP disclosed
WO-1997036939-A1 A NOVEL COMPOSITION, ITS PREPARATION AND USE BOREALIS A/S (DK) 1997-10-09 WO disclosed