SCHEMBL711567

SCHEMBL711567

CC(C)(C)n1nc(Cc2ccc(Cl)cc2)cc1Nc1ccc(S(=O)(=O)Nc2nncs2)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 3/20 0.49
AKT1 P31749 10/20 0.46
PDPK1 O15530 1/20 0.44
ABCB11 O95342 1/20 0.44
AKT2 P31751 1/20 0.44
GAB1 Q13480 1/20 0.44
AKT3 Q9Y243 1/20 0.44
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41
HTT P42858 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
SCHEMBL712431 0.86 SCN9A (0.66) SCN9AMEN1KMT2A
SCHEMBL713267 0.80 KDM4E (0.53) SCN9AMEN1KMT2AHTT
SCHEMBL712664 0.77 SCN9A (0.55) SCN9AMEN1KMT2A
SCHEMBL710233 0.75 SCN9A (0.62) SCN9A
SCHEMBL712892 0.74 SCN9A (0.63) SCN9AMEN1KMT2A
SCHEMBL712534 0.72 SCN9A (0.54) SCN9AMEN1TSHRKMT2A
SCHEMBL713144 0.71 SCN9A (0.53) SCN9AMEN1KMT2A
SCHEMBL711822 0.67 SCN9A (0.53) SCN9A
SCHEMBL711214 0.67 SCN9A (0.53) SCN9AMEN1KMT2A
SCHEMBL711821 0.67 SCN9A (0.52) SCN9A

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 SCN9A 17/4885AKT1 2271/4885PDPK1 2126/4885

“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.