SCHEMBL5349852

SCHEMBL5349852

C=CC(=O)OC1CC(C)(C23CC4CC(CC(C4)C2)C3)OC1=O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.33
OPRK1 P41145 1/20 0.33
NAAA Q02083 1/20 0.30

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
SCHEMBL14593997 0.88 HSD11B1 (0.33) OPRM1OPRK1
SCHEMBL685107 0.79 OPRM1 (0.34) OPRM1OPRK1
SCHEMBL4614409 0.74 NAAA (0.34) NAAA
SCHEMBL12651233 0.69 NLRP3 (0.32) OPRM1OPRK1
SCHEMBL685729 0.66 TSHR (0.33)
SCHEMBL685651 0.65 KMT2A (0.33) OPRM1OPRK1
SCHEMBL1697094 0.64 TSHR (0.37)
SCHEMBL284285 0.64
SCHEMBL31534014 0.64 POLB (0.32)
SCHEMBL12130474 0.63

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
US-7183423-B1 Process for the preparation of organic compounds with imide catalysts DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-02-27 US disclosed
US-7183423-B1 Process for the preparation of organic compounds with imide catalysts DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-02-27 US disclosed
US-7183423-B1 Process for the preparation of organic compounds with imide catalysts DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-02-27 US disclosed
EP-1055654-A1 PROCESS FOR THE PREPARATION OF ORGANIC COMPOUNDS WITH IMIDE CATALYSTS Daicel Chemical Industries, Ltd. (JP) 2000-11-29 EP disclosed