SCHEMBL22798307

SCHEMBL22798307

O=C(NCCOc1ccc(OC(F)(F)F)cc1Cl)c1ccnc(NC(=O)C2CC2)n1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.42
KDR P35968 10/20 0.41
BRAF P15056 7/20 0.41
MALT1 Q9UDY8 1/20 0.41
JAK1 P23458 1/20 0.40
GSK3A P49840 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK14 Q16539 1/20 0.39
TYK2 P29597 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
MCHR1 Q99705 1/20 0.38

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
SCHEMBL22797751 0.88 MEN1 (0.48) KDRBRAFMEN1LMNAPOLB
SCHEMBL20595168 0.85 KDR (0.46) GSK3BKDRBRAFGSK3ATYK2
SCHEMBL22798424 0.84 GSK3B (0.53) GSK3BKDRBRAFGSK3ATYK2
SCHEMBL2716568 0.82 SCN3A (0.51) KDRBRAFMALT1MEN1LMNA
SCHEMBL20595232 0.81 SCN9A (0.48) GSK3BKDRBRAFGSK3AMEN1
SCHEMBL22798296 0.80 KDR (0.45) KDRBRAFMEN1LMNAPOLB
SCHEMBL20595235 0.80 KDR (0.44) KDRBRAFMEN1LMNAPOLB
SCHEMBL2715423 0.79 KDR (0.47) GSK3BKDRBRAFJAK1GSK3A
SCHEMBL22797760 0.79 SCN9A (0.54) GSK3BKDRBRAFGSK3AMEN1
SCHEMBL20595227 0.79 KMT2A (0.41) GSK3BKDRBRAFMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110612285-B Amide derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2023-04-04 CN claimed
EP-3487839-B1 AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RAQUALIA PHARMA INC (JP) 2020-12-23 EP claimed
CN-110612285-A Amide derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2019-12-24 CN claimed
CN-110612285-B Amide derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2023-04-04 CN disclosed
US-11154544-B2 Amide derivatives as Nav1.7 and Nav1.8 blockers RAQUALIA PHARMA INC. (JP) 2021-10-26 US disclosed
EP-3487839-B1 AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS RAQUALIA PHARMA INC (JP) 2020-12-23 EP disclosed
CN-110612285-A Amide derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2019-12-24 CN 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-11154544-B2 Amide derivatives as Nav1.7 and Nav1.8 blockers SCN8A, SCN7A, SCN1A GSK3B 1727/4885KDR 4122/4885BRAF 1661/4885

“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.