SCHEMBL17255489

SCHEMBL17255489

O=C(O)N1CC(OCC(F)F)C1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.33
SCN10A Q9Y5Y9 1/20 0.33
SPR P35270 1/20 0.33

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
SCHEMBL18711795 0.82 CHRNB2 (0.39) SCN9ASCN10ASPR
SCHEMBL16416432 0.81 PRMT5 (0.33)
SCHEMBL18702205 0.78 PRMT5 (0.34) SCN9ASCN10ASPR
SCHEMBL17685921 0.77 HCRTR1 (0.30)
SCHEMBL15885747 0.75 PRMT5 (0.50)
SCHEMBL30395803 0.75 PDK2 (0.36)
SCHEMBL14697505 0.74 SPR (0.34) SPR
SCHEMBL17686039 0.74 AGTR2 (0.39)
SCHEMBL16415506 0.73 PDK2 (0.38)
SCHEMBL26089686 0.73

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2944637-B1 NITROGEN-CONTAINING HETEROCYLIC COMPOUND OR SALT THEREOF FUJIFILM CORP (JP) 2020-02-19 EP disclosed
EP-2944637-A1 NITROGEN-CONTAINING HETEROCYLIC COMPOUND OR SALT THEREOF FUJIFILM Corporation (JP) 2015-11-18 EP disclosed