SCHEMBL4245362

SCHEMBL4245362

O=C(O)c1ccccc1Nc1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 15/20 0.74
FABP4 P15090 2/20 0.54
PTGS1 P23219 2/20 0.52
AKR1C3 P42330 2/20 0.52
AKR1C2 P52895 2/20 0.52
PTGS2 P35354 1/20 0.52
CLCN2 P51788 1/20 0.52
ADRA2B P18089 1/20 0.52
ADRA2C P18825 1/20 0.52
MPO P05164 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
SCHEMBL6476569 0.86 MEN1 (0.62) TAS2R14FABP4PTGS1AKR1C3AKR1C2
SCHEMBL23691078 0.86 TAS2R14 (0.74) TAS2R14FABP4PTGS1AKR1C3AKR1C2
SCHEMBL11338181 0.85 TAS2R14 (0.72) TAS2R14FABP4PTGS1AKR1C3AKR1C2
SCHEMBL12697392 0.84 TAS2R14 (0.54) TAS2R14AKR1C3AKR1C2MPO
SCHEMBL6482325 0.82 TAS2R14 (0.53) TAS2R14FABP4PTGS1AKR1C3AKR1C2
SCHEMBL2625434 0.80 TAS2R14 (0.65) TAS2R14FABP4PTGS1AKR1C3AKR1C2
SCHEMBL4245559 0.78 MAPK8 (0.67) TAS2R14FABP4PTGS1AKR1C3AKR1C2
SCHEMBL1358523 0.77 TAS2R14 (0.75) TAS2R14FABP4AKR1C3AKR1C2CLCN2
Flufenamic Acid SCHEMBL17497 0.77 RXFP1 (0.75) TAS2R14PTGS1AKR1C3AKR1C2PTGS2
Flufenamic Acid SCHEMBL29356958 0.77 RXFP1 (0.75) TAS2R14PTGS1AKR1C3AKR1C2PTGS2

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-20090131527-A1 NOVEL ANTHRANILIC ACID DERIVATIVES AND CHLORIDE CHANNEL BLOCKING AGENT CONTAINING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-05-21 US claimed
US-20090131527-A1 NOVEL ANTHRANILIC ACID DERIVATIVES AND CHLORIDE CHANNEL BLOCKING AGENT CONTAINING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2009-05-21 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 (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-20090131527-A1 NOVEL ANTHRANILIC ACID DERIVATIVES AND CHLORIDE CHANNEL BLOCKING AGENT CONTAINING THE SAME CLIC1, ASIC1, CLIC4 TAS2R14 1778/4885FABP4 1600/4885PTGS1 942/4885

“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.