SCHEMBL3052293

SCHEMBL3052293

CN(C(=O)c1ccc(C(F)(F)F)cc1Cl)c1ccc(Oc2ccc3cc(C(=O)N4CCN(C(=O)OC(C)(C)C)CC4)n(C)c3c2)nc1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 11/20 0.46
SCN9A Q15858 8/20 0.44
GPR119 Q8TDV5 1/20 0.43

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
SCHEMBL3067357 0.93 STAT3 (0.46) STAT3SCN9A
SCHEMBL3067761 0.90 SCN9A (0.51) STAT3SCN9A
SCHEMBL3055576 0.90 STAT3 (0.51) STAT3SCN9A
Bromide SCHEMBL3066736 0.86 STAT3 (0.60) STAT3
SCHEMBL10182050 0.86 STAT3 (0.48) STAT3SCN9A
SCHEMBL3055936 0.86 HRH3 (0.44) STAT3
SCHEMBL10180871 0.85 STAT3 (0.55) STAT3
SCHEMBL15295459 0.85 STAT3 (0.55) STAT3
Bromide SCHEMBL3064542 0.85 STAT3 (0.54) STAT3
Bromide SCHEMBL3046167 0.85 STAT3 (0.54) 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
US-20100261720-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-10-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100261720-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF COL1A1, COL2A1, COL14A1 STAT3 1499/4885SCN9A 2616/4885GPR119 706/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.