SCHEMBL22833733

SCHEMBL22833733

Cc1cc(F)ccc1Nc1ncc(C(F)(F)F)cc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK2 Q9HBH9 1/20 0.47
▸ MPO P05164 1/20 0.46
▸ SORT1 Q99523 2/20 0.46
▸ DHODH Q02127 7/20 0.45
▸ TAS2R14 Q9NYV8 2/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.41
▸ GRIK1 P39086 1/20 0.41
▸ AGBL2 Q5U5Z8 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ GMNN O75496 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TTR P02766 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ UGT1A1 P22309 1/20 0.40
▸ PTGS1 P23219 1/20 0.40

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
SCHEMBL29382196 1.00 MKNK2 (0.47) MKNK2MPOSORT1DHODHTAS2R14
SCHEMBL30294412 0.91 SORT1 (0.54) SORT1DHODHTAS2R14HDAC6AGBL2
SCHEMBL22853174 0.91 SORT1 (0.54) SORT1DHODHTAS2R14HDAC6AGBL2
SCHEMBL22853164 0.87 ALDH1A1 (0.52) MPOSORT1DHODHTAS2R14HDAC6
SCHEMBL30294847 0.87 ALDH1A1 (0.52) MPOSORT1DHODHTAS2R14HDAC6
SCHEMBL22853090 0.86 MPO (0.45) MPOSORT1DHODHTAS2R14GRIK1
SCHEMBL30294820 0.86 MPO (0.45) MPOSORT1DHODHTAS2R14GRIK1
SCHEMBL22853108 0.85 MPO (0.44) MPOSORT1DHODHTAS2R14HDAC6
SCHEMBL30294675 0.85 MPO (0.44) MPOSORT1DHODHTAS2R14HDAC6
SCHEMBL22833312 0.84 DHODH (0.56) SORT1DHODHTAS2R14HDAC6AGBL2

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 4 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
EP-3990436-A1 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2022-05-04 — — EP disclosed
WO-2020261114-A1 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-12-30 — — WO 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 MKNK2 1822/4885MPO 3074/4885SORT1 3573/4885

“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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