SCHEMBL10180588

SCHEMBL10180588

Cc1cc(C(F)(F)F)ccc1C(=O)Nc1ccc(Oc2ccc3cc(C(=O)N4CCN(Cc5ccc(OC(CF)CF)cc5)CC4)n(C)c3c2)nc1

nearest known ligand 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 20/20 0.56

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
Hydrochloric Acid SCHEMBL3061452 0.99 STAT3 (0.55) STAT3
Bromide SCHEMBL3051029 0.94 STAT3 (0.55) STAT3
Bromide SCHEMBL3061036 0.94 STAT3 (0.55) STAT3
Hydrochloric Acid SCHEMBL3064914 0.94 STAT3 (0.56) STAT3
Hydrochloric Acid SCHEMBL3061532 0.94 STAT3 (0.57) STAT3
SCHEMBL3062107 0.93 STAT3 (0.55) STAT3
Hydrochloric Acid SCHEMBL3061465 0.93 STAT3 (0.57) STAT3
Bromide SCHEMBL3061179 0.93 STAT3 (0.61) STAT3
Bromide SCHEMBL3064380 0.92 STAT3 (0.53) STAT3
SCHEMBL10181408 0.91 STAT3 (0.45) 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 claimed
EP-2207773-B1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMA CO LTD (JP) 2012-07-11 EP claimed