SCHEMBL22853381

SCHEMBL22853381

COC(=O)c1cc(C(F)(F)F)ccc1Nc1c(C)cc(F)cc1F

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 1/20 0.47
▸ TAS2R14 Q9NYV8 1/20 0.42
▸ SCN8A Q9UQD0 6/20 0.41
▸ SCN10A Q9Y5Y9 6/20 0.41
▸ MRGPRX4 Q96LA9 1/20 0.40
▸ DHODH Q02127 1/20 0.39
▸ MPO P05164 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ ESRRA P11474 1/20 0.38
▸ HPGD P15428 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
SCHEMBL30294713 0.88 TAS2R14 (0.52) TAS2R14DHODHMPO
SCHEMBL22853391 0.88 TAS2R14 (0.52) TAS2R14DHODHMPO
SCHEMBL22853387 0.84 CFTR (0.48) CFTRTAS2R14SCN8ASCN10AMRGPRX4
SCHEMBL29383454 0.84 CFTR (0.50) CFTRTAS2R14SCN8ASCN10AMRGPRX4
SCHEMBL22833864 0.84 CFTR (0.50) CFTRTAS2R14SCN8ASCN10AMRGPRX4
SCHEMBL30294444 0.81 TAS2R14 (0.50) CFTRTAS2R14MRGPRX4DHODHMPO
SCHEMBL22852770 0.81 TAS2R14 (0.50) CFTRTAS2R14MRGPRX4DHODHMPO
SCHEMBL30294869 0.80 SORT1 (0.46) SCN8ASCN10ADHODHKDM4EHPGD
SCHEMBL22853070 0.80 SORT1 (0.46) SCN8ASCN10ADHODHKDM4EHPGD
SCHEMBL22853086 0.79 CFTR (0.50) CFTRTAS2R14SCN8ASCN10AMRGPRX4

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-20230103791-A1 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-04-06 — — US disclosed
WO-2020261114-A1 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-12-30 — — WO 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-20230103791-A1 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS SCN8A, SCN1A, SCN1B CFTR 402/4885TAS2R14 1406/4885SCN8A 1/4885

“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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