SCHEMBL10572302

SCHEMBL10572302

CSc1cc(N)c(SC)c(SC)c1SC

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
CNKSR1 Q969H4 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
SCHEMBL16781734 0.82
SCHEMBL9130885 0.82
SCHEMBL10572123 0.77 NPC1 (0.38) NPC1RAB9A
SCHEMBL28716249 0.74 NPC1 (0.41) NPC1RAB9A
SCHEMBL8934247 0.73 NPC1 (0.31) NPC1RAB9A
SCHEMBL175685 0.73 NPC1 (0.35) NPC1RAB9A
SCHEMBL28463583 0.73 NPC1 (0.31) NPC1RAB9A
SCHEMBL15299 0.73 NPC1 (0.31) NPC1RAB9A
SCHEMBL8675667 0.72 ALDH1A1 (0.38) CNKSR1
SCHEMBL9985255 0.72 MEN1 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4866209-A Poly(hydrocarbylthio)anilines ETHYL CORPORATION (US) 1989-09-12 US disclosed
EP-0169101-B1 PROCESS FOR PREPARING (HYDROCARBYLTHIO)CYCLIC AMINES ETHYL CORPORATION (US) 1988-08-24 EP disclosed
US-4594453-A Reacting hydrocarbyl disulfide with aromatic amine ETHYL CORPORATION (US) 1986-06-10 US disclosed
EP-0169101-A1 Process for preparing (hydrocarbylthio)cyclic amines ETHYL CORPORATION (US) 1986-01-22 EP disclosed