SCHEMBL11063131

SCHEMBL11063131

CCCC(C)(Oc1ccc(Cc2ccc(Cl)cc2)cc1)C(=O)OCC

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.81
PPARA Q07869 7/20 0.60
CYP1A2 P05177 3/20 0.60
CYP3A4 P08684 3/20 0.60
ABCB11 O95342 2/20 0.60
TSHR P16473 2/20 0.60
HTR2A P28223 2/20 0.60
PMP22 Q01453 2/20 0.60
PPARG P37231 5/20 0.47
ALDH1A1 P00352 3/20 0.45
MAPT P10636 4/20 0.42
MEN1 O00255 2/20 0.42
CYP2C19 P33261 2/20 0.42
KMT2A Q03164 2/20 0.42
ELANE P08246 2/20 0.42
CYP2D6 P10635 1/20 0.42
FABP2 P12104 2/20 0.41
SLC22A12 Q96S37 1/20 0.41
LMNA P02545 4/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL11070815 0.94 OPRK1 (0.79) OPRK1PPARACYP1A2CYP3A4ABCB11
Beclobrate SCHEMBL3950803 0.90 OPRK1 (1.00) OPRK1PPARACYP1A2CYP3A4ABCB11
Beclobrate SCHEMBL49779 0.90 OPRK1 (1.00) OPRK1PPARACYP1A2CYP3A4ABCB11
SCHEMBL11066953 0.88 OPRK1 (0.63) OPRK1PPARACYP1A2CYP3A4ABCB11
SCHEMBL11639698 0.85 OPRK1 (0.62) OPRK1PPARACYP1A2CYP3A4ABCB11
SCHEMBL11074943 0.84 PPARA (0.86) OPRK1PPARACYP1A2CYP3A4ABCB11
SCHEMBL1935420 0.82 OPRK1 (0.86) OPRK1PPARACYP1A2CYP3A4ABCB11
SCHEMBL11287108 0.82 OPRK1 (0.56) OPRK1PPARACYP1A2CYP3A4ABCB11
SCHEMBL11071767 0.82 OPRK1 (0.81) OPRK1PPARACYP1A2CYP3A4ABCB11
SCHEMBL11638335 0.81 OPRK1 (0.55) OPRK1PPARACYP1A2CYP3A4ABCB11

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
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 claimed
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