SCHEMBL28463583

SCHEMBL28463583

CSc1cc(N)c(SC)c(C)c1N

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL8934247 0.82 NPC1 (0.31) NPC1RAB9A
SCHEMBL308607 0.82 NPC1 (0.31) NPC1RAB9A
SCHEMBL15299 0.82 NPC1 (0.31) NPC1RAB9A
SCHEMBL3683818 0.80 PTK2 (0.37) NPC1RAB9A
SCHEMBL48437 0.80 ALDH1A1 (0.33) NPC1RAB9A
SCHEMBL7190301 0.77 NPC1 (0.31) NPC1RAB9A
SCHEMBL175685 0.77 NPC1 (0.35) NPC1RAB9A
SCHEMBL13610641 0.76 ALDH1A1 (0.31)
SCHEMBL9130885 0.76
SCHEMBL15256900 0.76 ALDH1A1 (0.32)

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
CN-108864399-B Organic silicon modified flame-retardant polyurethane and preparation thereof 汕头大学 2020-12-29 CN claimed
CN-108864399-B Organic silicon modified flame-retardant polyurethane and preparation thereof 汕头大学 2020-12-29 CN disclosed
CN-109134812-B Composite antibacterial polyurethane block polymer and preparation and application thereof 汕头大学 2020-11-03 CN disclosed
CN-108690178-B Preparation method of polysulfide polyurea with self-repairing function 南京大学 2020-10-16 CN disclosed