SCHEMBL9320892

SCHEMBL9320892

O=S(=O)(CC1CC1)c1nc[nH]n1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.35
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
AOC2 O75106 2/20 0.34
SCN9A Q15858 2/20 0.34
JAK2 O60674 2/20 0.32
JAK1 P23458 2/20 0.32
TYK2 P29597 2/20 0.32
JAK3 P52333 2/20 0.32
SCN5A Q14524 1/20 0.32
ALOX5AP P20292 1/20 0.30
FEN1 P39748 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
SCHEMBL9320812 0.93 RIPK1 (0.31) RIPK1MAOAMAOBAOC2SCN9A
SCHEMBL9322886 0.93 CDK2 (0.32) RIPK1MAOAMAOBAOC2SCN9A
SCHEMBL9320191 0.92 CDK2 (0.33) RIPK1SCN9AJAK2JAK1TYK2
SCHEMBL9321633 0.92 CDK2 (0.33) RIPK1SCN9AJAK2JAK1TYK2
SCHEMBL11370619 0.75 PSIP1 (0.32)
SCHEMBL21293714 0.75 JAK2 (0.31) JAK2JAK1TYK2
SCHEMBL21293353 0.74 AOC2 (0.31) MAOAMAOBAOC2
SCHEMBL11375532 0.70 LOXL2 (0.37) RIPK1
SCHEMBL22494208 0.69
SCHEMBL11382801 0.69

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-5308830-A Low dosage; nonphytotoxic to crops; pre- and postemergence ROHM AND HAAS COMPANY (US) 1994-05-03 US disclosed