SCHEMBL3050867

SCHEMBL3050867

Cc1nc(Oc2ccc3c(c2)cc(C(=O)N2CCN(Cc4ccccn4)CC2)n3C)ccc1NC(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.53
STAT3 P40763 13/20 0.47
SRPK1 Q96SB4 3/20 0.43
PIK3CA P42336 1/20 0.43
PRKAA2 P54646 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
SCHEMBL3052640 0.90 SCN9A (0.54) SCN9ASTAT3SRPK1PIK3CAPRKAA2
Bromide SCHEMBL3069488 0.89 STAT3 (0.52) STAT3PIK3CAPRKAA2
Bromide SCHEMBL10182145 0.87 STAT3 (0.57) STAT3PIK3CAPRKAA2
SCHEMBL3057206 0.86 SCN9A (0.56) SCN9ASTAT3PIK3CAPRKAA2
SCHEMBL3064956 0.86 SCN9A (0.51) SCN9ASTAT3PIK3CAPRKAA2
SCHEMBL3061312 0.84 SCN9A (0.46) SCN9ASTAT3
SCHEMBL3063504 0.83 SCN9A (0.43) SCN9ASTAT3
SCHEMBL3068127 0.83 SCN9A (0.59) SCN9ASTAT3
SCHEMBL3066677 0.82 SCN9A (0.59) SCN9ASTAT3PIK3CAPRKAA2
Bromide SCHEMBL3062140 0.80 PTGS2 (0.52) STAT3PIK3CAPRKAA2

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 1499/4885SRPK1 4183/4885

“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.