SCHEMBL5551371

SCHEMBL5551371

CCCCCCCCCCCCCCCc1cccc(O)c1C(=O)c1ccccc1.CCCCCCCCCCCCCCCc1cccc(OC)c1C(=O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.69
BID P55957 6/20 0.62
MCL1 Q07820 6/20 0.62
BCL2L1 Q07817 5/20 0.62
BAK1 Q16611 5/20 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 0.55
F3 P13726 3/20 0.55
MMP2 P08253 2/20 0.55
KDM4E B2RXH2 1/20 0.55
MAPT P10636 1/20 0.55
ALOX15 P16050 1/20 0.55
ECE1 P42892 1/20 0.55
SGMS1 Q86VZ5 1/20 0.55

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
SCHEMBL4294270 0.94 PPARA (0.78) PPARABIDMCL1BCL2L1BAK1
SCHEMBL4292268 0.90 BID (0.76) PPARABIDMCL1BCL2L1BAK1
Diethylamine SCHEMBL27776404 0.84 BID (0.67) PPARABIDMCL1BCL2L1BAK1
SCHEMBL18030237 0.82 PPARA (1.00) PPARABIDMCL1BCL2L1BAK1
SCHEMBL2940835 0.82 PPARA (1.00) PPARABIDMCL1BCL2L1BAK1
SCHEMBL31220510 0.81 BID (0.59) PPARABIDMCL1BCL2L1BAK1
SCHEMBL29633009 0.81 BID (0.59) PPARABIDMCL1BCL2L1BAK1
SCHEMBL11150170 0.81 BID (0.69) PPARABIDMCL1BCL2L1BAK1
SCHEMBL28931275 0.79 BID (0.71) PPARABIDMCL1BCL2L1BAK1
SCHEMBL11740819 0.79 CA1 (0.58) KDM4EMAPTALOX15HSD17B10

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
EP-1812027-A2 COMPOUNDS CAPABLE OF ABSORBING ULTRAVIOLET RADIATION, COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION Universidade Federal Do Rio De Janeiro - UFRJ (BR) 2007-08-01 EP disclosed
WO-2006042391-A2 PHOTOPROTECTIVE PHENOL DERIVATIVES OBTAINED FROM CASHEW NUT-SHELL LIQUID UNIVERSIDADE FEDERAL DO RIO DE JANEIRO-UFRJ (BR) 2006-04-27 WO disclosed