SCHEMBL11074765

SCHEMBL11074765

CCOC(=O)C(C)(CC)Oc1ccc(Cc2ccc(Cl)cc2)c(C)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.76
PPARA Q07869 4/20 0.51
ABCB11 O95342 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
TSHR P16473 1/20 0.51
HTR2A P28223 1/20 0.51
PMP22 Q01453 1/20 0.51
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 2/20 0.41
PPARG P37231 3/20 0.40
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
Beclobrate SCHEMBL49779 0.87 OPRK1 (1.00) OPRK1PPARAABCB11CYP1A2CYP3A4
Beclobrate SCHEMBL3950803 0.87 OPRK1 (1.00) OPRK1PPARAABCB11CYP1A2CYP3A4
SCHEMBL1935420 0.83 OPRK1 (0.86) OPRK1PPARAABCB11CYP1A2CYP3A4
SCHEMBL11288479 0.79 OPRK1 (0.68) OPRK1PPARAABCB11CYP1A2CYP3A4
SCHEMBL5997445 0.78 OPRK1 (0.78) OPRK1PPARAABCB11CYP1A2CYP3A4
SCHEMBL11071767 0.77 OPRK1 (0.81) OPRK1PPARAABCB11CYP1A2CYP3A4
SCHEMBL11063131 0.77 OPRK1 (0.81) OPRK1PPARAABCB11CYP1A2CYP3A4
SCHEMBL11070815 0.76 OPRK1 (0.79) OPRK1PPARAABCB11CYP1A2CYP3A4
SCHEMBL11470655 0.76 OPRK1 (0.79) OPRK1PPARAABCB11CYP1A2CYP3A4
SCHEMBL11072228 0.75 OPRK1 (0.78) OPRK1PPARAABCB11CYP1A2CYP3A4

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-4483999-A Phenoxy alkanoic acid derivatives having the ability to lower the level of fatty substances in the blood SIEGFRIED AKTIENGESELLSCHAFT (CH) 1984-11-20 US disclosed