SCHEMBL20094431

SCHEMBL20094431

CN(Cc1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1)CS(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CACNA1H O95180 12/20 0.48
▸ ALDH1A1 P00352 1/20 0.43
▸ CACNA1C Q13936 7/20 0.43
▸ CACNA1B Q00975 7/20 0.43
▸ CACNA1G O43497 3/20 0.43
▸ LMNA P02545 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL20094238 0.91 CACNA1H (0.52) CACNA1HALDH1A1CACNA1CCACNA1BCACNA1G
SCHEMBL20088395 0.88 CACNA1H (0.38) CACNA1HALDH1A1CACNA1CCACNA1BCACNA1G
SCHEMBL15844031 0.88 CACNA1H (0.54) CACNA1HALDH1A1CACNA1CCACNA1BCACNA1G
SCHEMBL15844092 0.86 CACNA1H (0.44) CACNA1HALDH1A1CACNA1CCACNA1BCACNA1G
SCHEMBL15852951 0.85 CACNA1H (0.41) CACNA1HCACNA1CCACNA1BCACNA1G
SCHEMBL15844215 0.84 CACNA1H (0.46) CACNA1HALDH1A1CACNA1CCACNA1BCACNA1G
SCHEMBL15850894 0.84 CACNA1H (0.68) CACNA1HALDH1A1CACNA1CCACNA1BCACNA1G
SCHEMBL15844641 0.81 CACNA1H (0.53) CACNA1HALDH1A1CACNA1CCACNA1BCACNA1G
SCHEMBL15844285 0.81 CACNA1H (0.53) CACNA1HALDH1A1CACNA1CCACNA1BCACNA1G
SCHEMBL15844578 0.81 CACNA1H (0.55) CACNA1HALDH1A1CACNA1CCACNA1BCACNA1G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10351514-B2 Benzimidazole inhibitors of the sodium channel Mark G. DeGiacomo, Interim Trustee (US) 2019-07-16 — — US disclosed
US-20180111894-A1 Benzimidazole Inhibitors of the Sodium Channel DeGiacomo, Mark G. (US) 2018-04-26 — — 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-10351514-B2 Benzimidazole inhibitors of the sodium channel SCN1A, KCNJ11, KCNJ1 CACNA1H 65/4885ALDH1A1 588/4885CACNA1C 49/4885
US-20180111894-A1 Benzimidazole Inhibitors of the Sodium Channel SCN1A, KCNJ11, KCNJ1 CACNA1H 65/4885ALDH1A1 588/4885CACNA1C 49/4885

“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.

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