SCHEMBL10165446

SCHEMBL10165446

COC(=O)NS(=O)(=O)c1ccc(NC(=O)Cn2c(C)cc3cc(Cl)ccc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRAF6 Q9Y4K3 1/20 0.47
MAPT P10636 2/20 0.46
TP53 P04637 1/20 0.46
PPARG P37231 3/20 0.44
KCNA5 P22460 2/20 0.43
RXFP1 Q9HBX9 2/20 0.42
THRB P10828 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 1/20 0.41
FLT1 P17948 2/20 0.41
FLT4 P35916 2/20 0.41
KDR P35968 2/20 0.41
PTGS2 P35354 1/20 0.40
KCNH2 Q12809 1/20 0.40

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
SCHEMBL10165440 0.85 RORC (0.48) TRAF6MAPTTP53KCNA5RXFP1
SCHEMBL10165494 0.81 TRAF6 (0.46) TRAF6MAPTTP53KCNA5RXFP1
SCHEMBL9972259 0.81 AVPR2 (0.58) MAPTSMN1; SMN2LMNAALDH1A1
SCHEMBL10165506 0.80 RXFP1 (0.54) MAPTKCNA5RXFP1LMNAALDH1A1
SCHEMBL10165467 0.78 RORC (0.50) MAPTTP53KCNA5LMNAKCNH2
SCHEMBL10165427 0.76 KCNA5 (0.46) MAPTKCNA5RXFP1SMN1; SMN2LMNA
SCHEMBL20601872 0.74 POLB (0.54) MAPTTHRBSMN1; SMN2LMNAALDH1A1
SCHEMBL4897413 0.74 MEN1 (0.58) MAPTTHRB
SCHEMBL134430 0.74 MEN1 (0.58) MAPTTHRB
SCHEMBL1467717 0.74 TDP1 (0.51) MAPTTHRBSMN1; SMN2LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8883766-B2 Ion channel modulators and methods of use VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-11-11 US disclosed
US-8883766-B2 Ion channel modulators and methods of use VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-11-11 US disclosed
US-20120208790-A1 ION CHANNEL MODULATORS AND METHODS OF USE VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-08-16 US disclosed
US-20120208790-A1 ION CHANNEL MODULATORS AND METHODS OF USE VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-08-16 US disclosed
US-8193194-B2 Ion channel modulators and methods of use VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-06-05 US disclosed
US-8193194-B2 Ion channel modulators and methods of use VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-06-05 US disclosed
US-20080293737-A1 ION CHANNEL MODULATORS AND METHODS OF USE VERTEX PHARMACEUTICALS INCORPORATED 2008-11-27 US disclosed
US-20080293737-A1 ION CHANNEL MODULATORS AND METHODS OF USE VERTEX PHARMACEUTICALS INCORPORATED 2008-11-27 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 (2 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-20120208790-A1 ION CHANNEL MODULATORS AND METHODS OF USE CACNA1G, CACNA1C, CACNA1B TRAF6 4758/4885MAPT 2165/4885TP53 4803/4885
US-20080293737-A1 ION CHANNEL MODULATORS AND METHODS OF USE CACNA1G, CACNA1C, CACNA1B TRAF6 4758/4885MAPT 2165/4885TP53 4803/4885

“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.