SCHEMBL17482991

SCHEMBL17482991

COC(C)(C)CNC(=O)c1noc(CO)c1CF

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CFTR P13569 2/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
NAMPT P43490 1/20 0.31
TRPV1 Q8NER1 2/20 0.31
SCN9A Q15858 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
SCHEMBL17483070 0.92 NPC1 (0.34) CFTRNPC1RAB9ANAMPTTRPV1
SCHEMBL19483599 0.90 NPC1 (0.32) CFTRNPC1RAB9ANAMPTTRPV1
SCHEMBL19484150 0.89 TRPV1 (0.32) CFTRNPC1RAB9ANAMPTTRPV1
SCHEMBL19483585 0.85 TRPV1 (0.33) CFTRNPC1RAB9ANAMPTTRPV1
SCHEMBL19484140 0.84 NPC1 (0.32) CFTRNPC1RAB9ANAMPTTRPV1
SCHEMBL17483027 0.83 NPC1 (0.33) CFTRNPC1RAB9ANAMPTTRPV1
SCHEMBL17483113 0.81 NPC1 (0.33) CFTRNPC1RAB9ANAMPT
SCHEMBL17482989 0.79 NPC1 (0.31) NPC1RAB9ANAMPTTRPV1
SCHEMBL17482990 0.79 KMT2A (0.38) CFTRNPC1RAB9ATRPV1
SCHEMBL17483030 0.78 MEN1 (0.36) CFTRNPC1RAB9ATRPV1

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-2016017467-A1 AMIDE COMPOUND AND USE OF SAME FOR NOXIOUS ARTHROPOD CONTROL 住友化学株式会社 2016-02-04 WO disclosed