SCHEMBL10769239

SCHEMBL10769239

CCCCCCCCNC(=O)CC(=O)N(C)CCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.55
DNM1 Q05193 2/20 0.54
NAAA Q02083 1/20 0.51
EPHX1 P07099 6/20 0.50
EPHX2 P34913 4/20 0.49
FAAH O00519 2/20 0.47

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
SCHEMBL4894256 1.00 CASP2 (0.55) CASP2DNM1NAAAEPHX1EPHX2
SCHEMBL7850881 1.00 CASP2 (0.55) CASP2DNM1NAAAEPHX1EPHX2
SCHEMBL20841985 1.00 CASP2 (0.55) CASP2DNM1NAAAEPHX1EPHX2
SCHEMBL29936144 0.92 DNM1 (0.48) CASP2DNM1NAAAEPHX1EPHX2
SCHEMBL7721736 0.92 DNM1 (0.48) CASP2DNM1NAAAEPHX1EPHX2
SCHEMBL18417892 0.87 TRPV1 (0.44) CASP2DNM1NAAA
SCHEMBL7918787 0.84 CASP2 (0.56) CASP2DNM1NAAAEPHX1FAAH
SCHEMBL10341548 0.83 EPHX2 (0.53) DNM1EPHX2
SCHEMBL20841987 0.83 TRPV1 (0.41) CASP2DNM1
SCHEMBL18461364 0.82 EPHX2 (0.46) DNM1EPHX1EPHX2

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
EP-0210928-A1 Extracting agents and propane diamides, their use to recover actinides and/or lanthanides and process for their preparation COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 1987-02-04 EP disclosed