SCHEMBL39315

SCHEMBL39315

CCCC(N)C(OC)OC

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.31
METAP1 P53582 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
Hydrochloric Acid SCHEMBL7420544 0.97
SCHEMBL28706046 0.84 OPRM1 (0.39) OPRM1
SCHEMBL13937906 0.82 OPRM1 (0.48) OPRM1
SCHEMBL8787472 0.80 OPRM1 (0.46) OPRM1
SCHEMBL1098140 0.77
SCHEMBL2633055 0.76
SCHEMBL2633054 0.76
SCHEMBL28929433 0.76
SCHEMBL24017050 0.75 OPRM1 (0.40) OPRM1METAP1
SCHEMBL428264 0.75 OPRM1 (0.40) OPRM1METAP1

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
WO-2012005693-A1 METHOD FOR THE SYNTHESIS OF AN AMINO ACETAL NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2012-01-12 WO disclosed