SCHEMBL11068359

SCHEMBL11068359

CCC(C)(Oc1ccc(Cc2ccc(Cl)cc2)cc1)C(=O)OC(C)C

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.73
CNR1 P21554 8/20 0.57
PPARA Q07869 7/20 0.57
PPARG P37231 4/20 0.57
CYP1A2 P05177 3/20 0.57
CYP3A4 P08684 3/20 0.57
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
ABCB11 O95342 2/20 0.57
TSHR P16473 2/20 0.57
HTR2A P28223 2/20 0.57
PMP22 Q01453 2/20 0.57
MAPT P10636 2/20 0.57
CYP2C19 P33261 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
USP2 O75604 1/20 0.57
LMNA P02545 1/20 0.57
ADORA3 P0DMS8 1/20 0.57
CYP2C9 P11712 1/20 0.57
ADRB3 P13945 1/20 0.57

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
SCHEMBL31742332 0.85 CNR1 (0.73) OPRK1CNR1PPARAPPARGCYP1A2
SCHEMBL11072228 0.85 OPRK1 (0.78) OPRK1CNR1PPARAPPARGCYP1A2
Beclobrate SCHEMBL49779 0.84 OPRK1 (1.00) OPRK1CNR1PPARAPPARGCYP1A2
Beclobrate SCHEMBL3950803 0.84 OPRK1 (1.00) OPRK1CNR1PPARAPPARGCYP1A2
SCHEMBL11071169 0.84 OPRK1 (0.76) OPRK1CNR1PPARAPPARGCYP1A2
SCHEMBL11478612 0.82 OPRK1 (0.73) OPRK1CNR1PPARAPPARGCYP1A2
SCHEMBL11073216 0.82 OPRK1 (0.73) OPRK1PPARAPPARGCYP1A2CYP3A4
SCHEMBL11071767 0.82 OPRK1 (0.81) OPRK1CNR1PPARAPPARGCYP1A2
SCHEMBL11470655 0.81 OPRK1 (0.79) OPRK1CNR1PPARAPPARGCYP1A2
SCHEMBL28262132 0.79 PPARG (0.46) OPRK1CNR1PPARAPPARGCYP1A2

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