SCHEMBL3063504

SCHEMBL3063504

Cc1nc(Oc2ccc3c(c2)cc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)n3C)ccc1NC(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 4/20 0.43
STAT3 P40763 11/20 0.43
LIPE Q05469 3/20 0.42
MAPT P10636 1/20 0.40
GPR119 Q8TDV5 1/20 0.39

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
SCHEMBL3055758 0.89 LGALS8 (0.40)
SCHEMBL3061312 0.89 SCN9A (0.46) SCN9ASTAT3LIPE
SCHEMBL3069060 0.88 STAT3 (0.46) SCN9ASTAT3LIPEMAPT
SCHEMBL3059483 0.87 RAB9A (0.49) SCN9ASTAT3MAPT
SCHEMBL3055776 0.85 STAT3 (0.41) SCN9ASTAT3MAPTGPR119
Bromide SCHEMBL3069488 0.85 STAT3 (0.52) STAT3
Bromide SCHEMBL10182145 0.85 STAT3 (0.57) STAT3
SCHEMBL3046701 0.84 STAT3 (0.44) SCN9ASTAT3MAPTGPR119
SCHEMBL3050867 0.83 SCN9A (0.53) SCN9ASTAT3
SCHEMBL3061525 0.81 SCN9A (0.50) SCN9ASTAT3

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 3 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
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 SCN9A 2616/4885STAT3 1499/4885LIPE 4198/4885

“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.