SCHEMBL787445

SCHEMBL787445

CC(=O)ON(c1ccccc1)c1cc(-c2ccc(Oc3ccc(F)cc3)cc2)cc(C(N)=O)n1

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 20/20 0.74
FPR2 P25090 1/20 0.48

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
SCHEMBL29421436 0.85 SCN9A (1.00) SCN9AFPR2
SCHEMBL787983 0.85 SCN9A (1.00) SCN9AFPR2
SCHEMBL29421496 0.81 SCN9A (1.00) SCN9A
SCHEMBL787444 0.81 SCN9A (0.89) SCN9A
SCHEMBL787784 0.81 SCN9A (1.00) SCN9A
SCHEMBL805902 0.80 SCN9A (0.80) SCN9A
SCHEMBL787072 0.79 SCN9A (0.79) SCN9A
SCHEMBL21236986 0.77 SCN9A (0.75) SCN9A
SCHEMBL787067 0.77 SCN9A (1.00) SCN9A
SCHEMBL787211 0.77 SCN9A (1.00) SCN9AFPR2

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-2616441-A2 PYRIDINE COMPOUNDS AND THE USES THEREOF Purdue Pharma LP (US) 2013-07-24 EP claimed
WO-2012035421-A2 PYRIDINE COMPOUNDS AND THE USES THEREOF PURDUE PHARMA L.P. (US) 2012-03-22 WO claimed