SCHEMBL10181035

SCHEMBL10181035

Cc1cc(Oc2ccc3cc(C(=O)N4CCN(Cc5ccc(OCC(F)(F)F)cc5)CC4)n(C)c3c2)ncc1N(C)C(=O)OC(C)(C)C

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 20/20 0.60

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
SCHEMBL3051166 0.89 STAT3 (0.62) STAT3
Bromide SCHEMBL3064047 0.88 STAT3 (0.65) STAT3
Bromide SCHEMBL3064378 0.87 STAT3 (0.59) STAT3
SCHEMBL3052190 0.86 STAT3 (0.61) STAT3
SCHEMBL3064973 0.85 STAT3 (0.65) STAT3
SCHEMBL3061791 0.84 STAT3 (0.63) STAT3
SCHEMBL3059206 0.84 STAT3 (0.56) STAT3
SCHEMBL31511221 0.82 STAT3 (0.73) STAT3
SCHEMBL3059273 0.82 STAT3 (0.63) STAT3
SCHEMBL22932876 0.82 STAT3 (0.71) STAT3

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
US-8551999-B2 Heterocyclic compound and pharmaceutical composition thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-10-08 US disclosed
EP-2207773-B1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMA CO LTD (JP) 2012-07-11 EP disclosed