SCHEMBL7942876

SCHEMBL7942876

CCCCCCCCCCCc1cccc(C(=O)OCC)c1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 6/20 0.62
MCL1 Q07820 6/20 0.62
BCL2L1 Q07817 5/20 0.62
BAK1 Q16611 5/20 0.62
PPARA Q07869 3/20 0.62
KAT8 Q9H7Z6 3/20 0.62
PPARG P37231 2/20 0.62
SAE1 Q9UBE0 2/20 0.62
EP300 Q09472 2/20 0.62
KAT5 Q92993 2/20 0.62
KAT2A Q92830 1/20 0.62
KAT2B Q92831 1/20 0.62
F7 P08709 3/20 0.54
F3 P13726 3/20 0.54
MMP2 P08253 2/20 0.54
KDM4E B2RXH2 1/20 0.54
MAPT P10636 1/20 0.54
ALOX15 P16050 1/20 0.54
ECE1 P42892 1/20 0.54
SGMS1 Q86VZ5 1/20 0.54

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
SCHEMBL29046943 1.00 BID (0.62) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL7932923 0.94 BID (0.54) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL11511193 0.92 BID (0.54) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL30423156 0.92 BID (0.54) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL383323 0.92 BID (0.54) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL9222428 0.92 BID (0.54) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL2045733 0.91 TSHR (0.62) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL21225342 0.91 TSHR (0.62) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL9568678 0.91 TSHR (0.62) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL1982048 0.91 TSHR (0.62) BIDMCL1BCL2L1BAK1PPARA

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