SCHEMBL28340591

SCHEMBL28340591

OCCOC1C[CH]CCC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 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
SCHEMBL7800148 0.86 KDM4E (0.32)
SCHEMBL7804039 0.82 NPC1 (0.34) NPC1
SCHEMBL7981676 0.81 TAAR1 (0.36) NPC1
SCHEMBL8082203 0.81 NPC1 (0.31) NPC1
SCHEMBL8067693 0.81 NPC1 (0.31) NPC1
SCHEMBL7802049 0.80 NPC1 (0.36) NPC1
SCHEMBL7804078 0.79
SCHEMBL330971 0.79
SCHEMBL321202 0.79
SCHEMBL7799831 0.78 NPC1 (0.33) NPC1

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-110615890-A Polycarbonate diols and polyurethanes formed therefrom 财团法人工业技术研究院 2019-12-27 CN disclosed