SCHEMBL19488771

SCHEMBL19488771

CCCNCc1nc2ccc(-c3ccc(-c4ccc5c(c4)CCc4[nH]c([C@@H]6CCCN6)nc4-5)cc3)cc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 1/20 0.41
AAK1 Q2M2I8 3/20 0.36

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
SCHEMBL19488291 0.99 SCN10A (0.41) SCN10AAAK1
SCHEMBL19488275 0.95 SCN10A (0.39) SCN10AAAK1
SCHEMBL10202373 0.83 SCN10A (0.55) SCN10AAAK1
SCHEMBL19488554 0.80 SCN10A (0.40) SCN10AAAK1
SCHEMBL19488471 0.80 SCN10A (0.40) SCN10AAAK1
SCHEMBL2627369 0.79 SCN10A (0.43) SCN10A
SCHEMBL10200255 0.79 SCN10A (0.51) SCN10AAAK1
SCHEMBL19488498 0.79 SCN10A (0.42) SCN10AAAK1
SCHEMBL19488603 0.78 SCN10A (0.40) SCN10A
SCHEMBL19488306 0.78 SCN10A (0.39) SCN10AAAK1

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
EP-2601188-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-10-18 EP disclosed