SCHEMBL12475575

SCHEMBL12475575

CCCCc1cccc(C(C)=O)c1CC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 3/20 0.43
MCL1 Q07820 3/20 0.43
PPARA Q07869 3/20 0.43
BCL2L1 Q07817 2/20 0.43
BAK1 Q16611 2/20 0.43
KAT8 Q9H7Z6 2/20 0.43
PPARG P37231 2/20 0.43
EP300 Q09472 1/20 0.43
KAT2A Q92830 1/20 0.43
KAT2B Q92831 1/20 0.43
KAT5 Q92993 1/20 0.43
SAE1 Q9UBE0 1/20 0.43
IAPP P10997 1/20 0.40
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
LTB4R Q15722 3/20 0.39
LTB4R2 Q9NPC1 2/20 0.39
TSHR P16473 2/20 0.39
LIPG Q9Y5X9 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL12475592 0.93 BID (0.43) BIDMCL1PPARABCL2L1BAK1
SCHEMBL12475388 0.92 BID (0.42) BIDMCL1PPARABCL2L1BAK1
SCHEMBL12475346 0.89 PRKCI (0.42) IAPPGABRA1GABRB2LTB4RLTB4R2
SCHEMBL13571301 0.86 BID (0.50) BIDMCL1PPARABCL2L1BAK1
SCHEMBL10499032 0.85 GABRA1 (0.48) IAPPGABRA1GABRB2TSHRHTT
SCHEMBL14688680 0.85 MEN1 (0.45) BIDMCL1PPARABCL2L1BAK1
SCHEMBL1131361 0.84 TSHR (0.46) BIDMCL1PPARABCL2L1BAK1
SCHEMBL18716719 0.83 BID (0.43) BIDMCL1PPARABCL2L1BAK1
SCHEMBL12475620 0.82 PRKCI (0.42) IAPPGABRA1GABRB2LTB4RLTB4R2
SCHEMBL1585398 0.81 ALOX5 (0.44) BIDMCL1PPARABCL2L1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2673326-A2 COATING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF COATING Valspar Sourcing, Inc. (US) 2013-12-18 EP disclosed
EP-2673323-A2 COATING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF COATING Valspar Sourcing, Inc. (US) 2013-12-18 EP disclosed
WO-2012161758-A2 COATING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF COATING VALSPAR SOURCING, INC. (US) 2012-11-29 WO disclosed
WO-2012109278-A2 COATING COMPOSITIONS FOR CONTAINERS AND OTHER ARTICLES AND METHODS OF COATING VALSPAR SOURCING, INC. (US) 2012-08-16 WO disclosed