SCHEMBL23779581

SCHEMBL23779581

Cc1nc(N2CCCCCC2)c(C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1C#N

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 17/20 0.78
ALDH1A1 P00352 2/20 0.51
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
MAPK1 P28482 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL29615263 1.00 SCN10A (0.78) SCN10AALDH1A1CA12CA1CA2
SCHEMBL23779565 0.88 SCN10A (1.00) SCN10ACA12CA1CA2CA9
SCHEMBL29615230 0.88 SCN10A (1.00) SCN10ACA12CA1CA2CA9
SCHEMBL23779638 0.86 SCN10A (0.82) SCN10ACA12CA1CA2CA9
SCHEMBL23779429 0.85 SCN10A (0.56) SCN10AALDH1A1KDM4EMEN1MAPK1
SCHEMBL29615314 0.85 SCN10A (0.56) SCN10AALDH1A1KDM4EMEN1MAPK1
SCHEMBL23779504 0.84 SCN10A (0.78) SCN10A
SCHEMBL29615275 0.83 SCN10A (1.00) SCN10ACA12CA1CA2CA9
SCHEMBL23779529 0.83 SCN10A (1.00) SCN10ACA12CA1CA2CA9
SCHEMBL23779602 0.82 SCN10A (0.70) SCN10A

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-20220119363-A1 2-AMINO-N-PHENYL-NICOTINAMIDES AS NAV1.8 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2022-04-21 US claimed
EP-3873468-A1 2-AMINO-N-PHENYL-NICOTINAMIDES AS NAV1.8 INHIBITORS Merck Sharp & Dohme Corp. (US) 2021-09-08 EP claimed
US-20220119363-A1 2-AMINO-N-PHENYL-NICOTINAMIDES AS NAV1.8 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2022-04-21 US disclosed
US-20220119363-A1 2-AMINO-N-PHENYL-NICOTINAMIDES AS NAV1.8 INHIBITORS MERCK SHARP & DOHME CORP. (US) 2022-04-21 US disclosed
EP-3873468-A1 2-AMINO-N-PHENYL-NICOTINAMIDES AS NAV1.8 INHIBITORS Merck Sharp & Dohme Corp. (US) 2021-09-08 EP 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-20220119363-A1 2-AMINO-N-PHENYL-NICOTINAMIDES AS NAV1.8 INHIBITORS SCN8A, TRPV1, SCN2A SCN10A 8/4885ALDH1A1 1424/4885CA12 3556/4885

“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.