SCHEMBL28516406

SCHEMBL28516406

CCC(CC)(CO)COC1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.34
NPC1 O15118 1/20 0.33
NAAA Q02083 1/20 0.32

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
SCHEMBL19218148 0.90
SCHEMBL28517294 0.88 NAAA (0.37) EPHX1NAAA
SCHEMBL27757261 0.88 NPC1 (0.38) EPHX1NPC1
SCHEMBL28890982 0.86 NPC1 (0.34) NPC1
SCHEMBL19218146 0.78
SCHEMBL3356852 0.77
SCHEMBL28517296 0.76 NPC1 (0.35) EPHX1NPC1NAAA
SCHEMBL9914881 0.74
SCHEMBL11279065 0.74
SCHEMBL5154352 0.74 EPHX1 (0.33) EPHX1NPC1NAAA

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
CN-106715374-B Polyether diol and process for producing the same 三菱瓦斯化学株式会社 2021-01-12 CN disclosed