SCHEMBL10165440

SCHEMBL10165440

COC(=O)NS(=O)(=O)c1ccc(NC(=O)Cn2ccc3cc(Cl)ccc32)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.48
KCNA5 P22460 3/20 0.47
RXFP1 Q9HBX9 1/20 0.47
KCNH2 Q12809 1/20 0.47
NPY5R Q15761 1/20 0.45
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TRAF6 Q9Y4K3 1/20 0.44
KRAS P01116 1/20 0.43
ATM Q13315 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
FLT1 P17948 1/20 0.43
FLT4 P35916 1/20 0.43
KDR P35968 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
SCHEMBL10165494 0.92 TRAF6 (0.46) RORCKCNA5RXFP1KCNH2NPY5R
SCHEMBL10165467 0.91 RORC (0.50) RORCKCNA5KCNH2TP53MAPT
SCHEMBL10165427 0.89 KCNA5 (0.46) KCNA5RXFP1ALDH1A1SMN1; SMN2ATM
SCHEMBL10165442 0.88 RORC (0.48) RORCRXFP1NPY5RALDH1A1SMN1; SMN2
SCHEMBL10165446 0.85 TRAF6 (0.47) KCNA5RXFP1KCNH2ALDH1A1SMN1; SMN2
SCHEMBL10165422 0.84 NPY5R (0.44) RORCKCNA5RXFP1KCNH2NPY5R
SCHEMBL10165420 0.84 MTNR1A (0.48) KCNA5KCNH2TP53
SCHEMBL10165506 0.83 RXFP1 (0.54) KCNA5RXFP1KCNH2ALDH1A1MAPT
SCHEMBL10165443 0.81 NPY5R (0.44) KCNA5KCNH2NPY5RALDH1A1SMN1; SMN2
SCHEMBL10165434 0.80 TP53 (0.45) TP53FLT1FLT4KDR

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 RORC 4749/4885KCNA5 32/4885RXFP1 3688/4885
US-20080293737-A1 ION CHANNEL MODULATORS AND METHODS OF USE CACNA1G, CACNA1C, CACNA1B RORC 4749/4885KCNA5 32/4885RXFP1 3688/4885

“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.