SCHEMBL4223672

SCHEMBL4223672

O=c1nc(-c2cc(Cl)cc(Cl)c2)[nH]n(CC(F)(F)F)c1=O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CXCR2 P25025 3/20 0.42
▸ ALDH1A1 P00352 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ KCNQ3 O43525 2/20 0.32
▸ KCNQ2 O43526 2/20 0.32
▸ PSD A5PKW4 2/20 0.32
▸ METAP2 P50579 1/20 0.30

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
SCHEMBL4223674 0.69 CNR1 (0.33) ALDH1A1GFERRXFP1METAP2
SCHEMBL4214908 0.60 NR1I2 (0.33) —
SCHEMBL4210571 0.59 MAP3K12 (0.33) METAP2
SCHEMBL11251103 0.57 ALDH1A1 (0.41) CXCR2ALDH1A1GFERRXFP1KCNQ3
SCHEMBL11846106 0.56 CCNA2 (0.31) ALDH1A1
SCHEMBL31617117 0.55 AURKA (0.36) ALDH1A1METAP2
SCHEMBL31617121 0.55 AURKA (0.36) ALDH1A1METAP2
SCHEMBL23778668 0.55 ALDH1A1 (0.42) CXCR2ALDH1A1GFERRXFP1
SCHEMBL20875438 0.54 MEN1 (0.34) ALDH1A1METAP2
SCHEMBL11260682 0.54 DGAT1 (0.40) ALDH1A1GFERRXFP1

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-7494996-B2 Substituted 4,5-dihydro-1,2,4-triazin-6-ones, 1,2,4-triazin-6-ones and their use as fungicides and insecticides DOW AGROSCIENCES LLC (US) 2009-02-24 — — US disclosed
US-20040242580-A1 Substituted 4,5-dihydro-1,2,4-triazin-6-ones, 1,2,4-triazin-6-ones and their use as fungicides and insecticides KELLY MARTHA JEAN (US) 2004-12-02 — — 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-20040242580-A1 Substituted 4,5-dihydro-1,2,4-triazin-6-ones, 1,2,4-triazin-6-ones and their use as fungicides and insecticides DDT, CYP4B1, CYP4X1 CXCR2 3489/4885ALDH1A1 255/4885GFER 1369/4885

“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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