SCHEMBL711670

SCHEMBL711670

Cn1nc(Cc2ccc(C(F)(F)F)cc2)cc1Nc1ccc(S(=O)(=O)Nc2nccs2)cc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SCN3A Q9NY46 4/20 0.58
SCN9A Q15858 11/20 0.53
SCN5A Q14524 3/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PKM P14618 2/20 0.43
ALDH1A1 P00352 1/20 0.43
ATM Q13315 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
SCHEMBL712892 0.89 SCN9A (0.63) SCN3ASCN9ASCN5AMEN1KMT2A
SCHEMBL712645 0.87 PKM (0.61) SCN3ASCN9AMEN1KMT2APKM
SCHEMBL711876 0.85 SCN9A (0.57) SCN3ASCN9ASCN5A
SCHEMBL711091 0.83 SCN9A (0.53) SCN3ASCN9ASCN5AMEN1KMT2A
SCHEMBL712666 0.83 KMT2A (0.49) SCN5AMEN1KMT2APKMALDH1A1
SCHEMBL713598 0.81 SCN9A (0.51) SCN9AMEN1KMT2APKM
SCHEMBL712431 0.79 SCN9A (0.66) SCN3ASCN9ASCN5AMEN1KMT2A
SCHEMBL713302 0.79 SCN9A (0.50) SCN9ASCN5AMEN1KMT2A
SCHEMBL708265 0.79 SCN9A (0.60) SCN9ASCN5A
SCHEMBL711825 0.79 ALDH1A1 (0.55) SCN9AMEN1KMT2APKMALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124610-B2 Sodium channel inhibitors ICAGEN INC. (US) 2012-02-28 US claimed
US-8124610-B2 Sodium channel inhibitors ICAGEN INC. (US) 2012-02-28 US disclosed
EP-2173743-A2 SODIUM CHANNEL INHIBITORS Icagen, Inc. (US) 2010-04-14 EP disclosed
US-20090023740-A1 SODIUM CHANNEL INHIBITORS ICAGEN (US) 2009-01-22 US disclosed
WO-2009012242-A2 SODIUM CHANNEL INHIBITORS ICAGEN, INC. (US) 2009-01-22 WO 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-20090023740-A1 SODIUM CHANNEL INHIBITORS TRPV1, SCN1A, SCN2A SCN3A 7/4885SCN9A 17/4885SCN5A 5/4885

“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.