SCHEMBL21295576

SCHEMBL21295576

CCCCC1(O)CC(O)C1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.37
HSD17B3 P37058 2/20 0.35
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
OPRL1 P41146 1/20 0.34

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
SCHEMBL18670682 0.91 GAA (0.41) GAA
SCHEMBL25340168 0.91 GAA (0.41) GAA
SCHEMBL13168808 0.83 HSD17B3 (0.40) GAAHSD17B3OPRM1OPRD1OPRK1
SCHEMBL28134719 0.80 LTB4R (0.40) GAAHSD17B3OPRM1OPRD1OPRK1
SCHEMBL27782291 0.77 OPRM1 (0.39) GAAHSD17B3OPRM1OPRD1OPRK1
SCHEMBL4096472 0.74 GAA (0.33) GAAHSD17B3OPRM1OPRD1OPRK1
SCHEMBL5169885 0.74
SCHEMBL483052 0.74
SCHEMBL29274247 0.73 LTB4R (0.41) GAAHSD17B3OPRM1OPRD1OPRK1
SCHEMBL13766437 0.73 GAA (0.33) GAA

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-2019163964-A1 POLYCARBONATE RESIN AND METHOD FOR MANUFACTURING SAME 帝人株式会社 2019-08-29 WO disclosed