SCHEMBL8892423

SCHEMBL8892423

CNC(=S)NS(=O)(=O)c1cc(CC(=O)NC(C)c2nccs2)ccc1SC

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
POLB P06746 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 1/20 0.35
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
ALDH1A1 P00352 2/20 0.34
PKM P14618 1/20 0.34
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
KMT2A Q03164 2/20 0.33
ABCC9 O60706 1/20 0.32
ABCC8 Q09428 1/20 0.32
KCNJ11 Q14654 1/20 0.32
SLC8A1 P32418 1/20 0.32
FFAR2 O15552 1/20 0.31
HTT P42858 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
SCHEMBL8892376 0.91 NPC1 (0.36) NPC1RAB9APOLBSMN1; SMN2GAA
SCHEMBL8892248 0.90 ALDH1A1 (0.35) POLBSMN1; SMN2LMNAMAPK1ALDH1A1
SCHEMBL8890057 0.89 NPC1 (0.37) NPC1RAB9APOLBSMN1; SMN2GAA
SCHEMBL8890655 0.86 LMNA (0.46) NPC1RAB9APOLBSMN1; SMN2GAA
SCHEMBL8893258 0.85 ALDH1A1 (0.47) NPC1RAB9APOLBSMN1; SMN2GAA
SCHEMBL8891787 0.85 HTT (0.35) GAALMNAALDH1A1PKMKMT2A
SCHEMBL8894341 0.84 L3MBTL1 (0.42) POLBLMNAALDH1A1PKMKMT2A
SCHEMBL8891930 0.84 ALDH1A1 (0.40) NPC1RAB9APOLBSMN1; SMN2GAA
SCHEMBL8890386 0.82 LMNA (0.35) RAB9APOLBSMN1; SMN2GAALMNA
SCHEMBL8891118 0.81 ALDH1A1 (0.36) POLBSMN1; SMN2LMNAMAPK1ALDH1A1

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
US-5607976-A ANNTIISCHEMIC AGENTS AND CARDIOVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-04 US disclosed