SCHEMBL3454834

SCHEMBL3454834

COC(=O)OCCCCCCCCCCCCOC(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.46
ACHE P22303 11/20 0.45
NAAA Q02083 1/20 0.44
TSHR P16473 3/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 1/20 0.42
FAAH O00519 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
SCHEMBL29315079 1.00 EPHX1 (0.46) EPHX1ACHENAAATSHRALDH1A1
SCHEMBL25906823 1.00 EPHX1 (0.46) EPHX1ACHENAAATSHRALDH1A1
SCHEMBL3454627 1.00 EPHX1 (0.46) EPHX1ACHENAAATSHRALDH1A1
SCHEMBL3453959 0.97 EPHX1 (0.43) EPHX1ACHENAAATSHRALDH1A1
SCHEMBL7051341 0.93 ALDH1A1 (0.52) EPHX1ACHENAAATSHRALDH1A1
SCHEMBL7056302 0.93 ALDH1A1 (0.52) EPHX1ACHENAAATSHRALDH1A1
SCHEMBL3454593 0.92 ALDH1A1 (0.40) EPHX1ACHENAAATSHRALDH1A1
SCHEMBL1833746 0.91 EPHX1 (0.61) EPHX1ACHENAAATSHRALDH1A1
SCHEMBL1835358 0.91 EPHX1 (0.61) EPHX1ACHENAAATSHRALDH1A1
SCHEMBL1835070 0.91 EPHX1 (0.61) EPHX1ACHENAAATSHRALDH1A1

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-2253710-B1 PROCESS FOR PREPARING ASYMMETRICAL CARBONATE COMPOUNDS UBE INDUSTRIES (JP) 2016-12-07 EP disclosed
EP-2253710-A1 ASYMMETRICAL CARBONATE COMPOUND AND MANUFACTURING METHOD THEREOF Ube Industries, Ltd. (JP) 2010-11-24 EP disclosed