SCHEMBL11344356

SCHEMBL11344356

Cc1nnc(CC([NH])=S)s1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 2/20 0.46
MAPT P10636 1/20 0.37
TRPM5 Q9NZQ8 1/20 0.32
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TP53 P04637 1/20 0.32
HTT P42858 1/20 0.31
HSD17B10 Q99714 1/20 0.31
F2 P00734 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
SCHEMBL9781931 0.71 F2 (0.62) RAB9ASMN1; SMN2NPC1MAPTGAA
SCHEMBL4324910 0.70
SCHEMBL19915088 0.69 RAB9A (0.42) RAB9ASMN1; SMN2NPC1MAPTTRPM5
SCHEMBL6781953 0.67
SCHEMBL25952192 0.67 SMN1; SMN2 (0.50) RAB9ASMN1; SMN2NPC1MAPTGAA
SCHEMBL11011542 0.67 SMN1; SMN2 (0.60) RAB9ASMN1; SMN2NPC1MAPTGAA
SCHEMBL13663825 0.66
SCHEMBL10042080 0.66
SCHEMBL14006743 0.66
SCHEMBL7036705 0.65

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-0002774-B1 PROCESS FOR ACYLATING 7AMINOCEPHEM DERIVATIVES HOECHST AKTIENGESELLSCHAFT (DE) 1981-09-23 EP disclosed