SCHEMBL4458435

SCHEMBL4458435

O=NSC[C@@H](Nc1nccs1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.43
RAB9A P51151 3/20 0.39
POLB P06746 1/20 0.39
LMNA P02545 3/20 0.39
TSHR P16473 2/20 0.39
NPC1 O15118 2/20 0.38
HSD17B10 Q99714 1/20 0.38
ALDH1A1 P00352 1/20 0.38
USP2 O75604 1/20 0.38
NR3C1 P04150 1/20 0.38
AURKA O14965 1/20 0.38
PIM1 P11309 1/20 0.38
CDK2 P24941 1/20 0.38
GSK3B P49841 1/20 0.38
ACP1 P24666 1/20 0.38
FFAR2 O15552 3/20 0.37
TP53 P04637 1/20 0.37
THRB P10828 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL4459655 1.00 FDPS (0.43) FDPSRAB9APOLBLMNATSHR
SCHEMBL4464682 1.00 FDPS (0.43) FDPSRAB9APOLBLMNATSHR
SCHEMBL4457429 0.86 FDPS (0.41) FDPSRAB9APOLBLMNATSHR
SCHEMBL4457430 0.86 FDPS (0.41) FDPSRAB9APOLBLMNATSHR
SCHEMBL4466235 0.85 FDPS (0.38) FDPSRAB9APOLBLMNATSHR
SCHEMBL4466228 0.85 FDPS (0.38) FDPSRAB9APOLBLMNATSHR
SCHEMBL8701152 0.79 FDPS (0.50) FDPSRAB9APOLBLMNATSHR
SCHEMBL8701148 0.79 FDPS (0.50) FDPSRAB9APOLBLMNATSHR
SCHEMBL4456265 0.78 FDPS (0.46) FDPSRAB9APOLBLMNATSHR
SCHEMBL4453114 0.78 FDPS (0.49) FDPSRAB9APOLBLMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009151744-A1 S-NITROSOMERCAPTO COMPOUNDS AND RELATED DERIVATIVES GALLEON PHARMACEUTICALS, INC. (US) 2009-12-17 WO claimed
WO-2009151744-A1 S-NITROSOMERCAPTO COMPOUNDS AND RELATED DERIVATIVES GALLEON PHARMACEUTICALS, INC. (US) 2009-12-17 WO disclosed