SCHEMBL354766

SCHEMBL354766

CCN(C(=O)COC)c1nsc2cccc(CC(F)F)c12

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 3/20 0.35
HCRTR2 O43614 3/20 0.35
TP53 P04637 1/20 0.32
OXTR P30559 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
SCHEMBL357050 0.87 KDM4E (0.34) HCRTR1HCRTR2
SCHEMBL352205 0.83 HCRTR1 (0.34) HCRTR1HCRTR2
SCHEMBL353612 0.82 MEN1 (0.35) HCRTR1HCRTR2TP53
SCHEMBL354277 0.73 HCRTR1 (0.35) HCRTR1HCRTR2
SCHEMBL10167672 0.73 HCRTR1 (0.35) HCRTR1HCRTR2TP53
SCHEMBL10167494 0.73 HCRTR1 (0.36) HCRTR1HCRTR2
SCHEMBL10167516 0.72 KCNA5 (0.41) TP53
SCHEMBL10167513 0.71 KCNA5 (0.42)
SCHEMBL355401 0.70 HPGD (0.34) HCRTR1HCRTR2
SCHEMBL10167462 0.69 TP53 (0.38) TP53

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-2064196-B1 3-AMINO-1,2-BENZISOTHIAZOLE COMPOUNDS FOR COMBATING ANIMAL PEST II BASF SE (DE) 2012-03-14 EP disclosed