SCHEMBL16013937

SCHEMBL16013937

O=[N+]([O-])c1ccc2c(c1)CC(c1cc(Cl)cc(Cl)c1)(C(F)(F)F)O2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PNMT P11086 4/20 0.35
▸ ADRA2A P08913 2/20 0.35
▸ MEN1 O00255 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ KDM1A O60341 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CA12 O43570 2/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA9 Q16790 2/20 0.33
▸ CA2 P00918 1/20 0.33
▸ TDP2 O95551 1/20 0.33
▸ VCAM1 P19320 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ DRD5 P21918 1/20 0.32
▸ DRD3 P35462 1/20 0.32
▸ P2RY6 Q15077 1/20 0.32

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
SCHEMBL16013293 0.81 TSHR (0.33) ALDH1A1TDP1MAPK1VCAM1HIF1A
SCHEMBL16013855 0.81 BACE1 (0.43) MEN1MAPTKMT2AKDM1ALMNA
SCHEMBL16013778 0.79 — —
SCHEMBL16013802 0.79 — —
SCHEMBL16013858 0.79 MAPT (0.31) MEN1MAPTKMT2AALDH1A1TDP1
SCHEMBL16013893 0.78 FABP4 (0.36) CA1CA9CA2
SCHEMBL16196771 0.78 ALDH1A1 (0.34) HSD17B10ALDH1A1TDP1
SCHEMBL16196813 0.77 PNMT (0.33) PNMTDRD3
SCHEMBL16196868 0.77 PPARA (0.32) —
SCHEMBL16197179 0.76 NPC1 (0.35) MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9598389-B2 Dihydrobenzofuran derivatives as insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-03-21 — — US disclosed
US-9598389-B2 Dihydrobenzofuran derivatives as insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-03-21 — — US disclosed
US-9598389-B2 Dihydrobenzofuran derivatives as insecticidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-03-21 — — US disclosed
US-20160016927-A1 DIHYDROBENZOFURAN DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-01-21 — — US disclosed
US-20160016927-A1 DIHYDROBENZOFURAN DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-01-21 — — US disclosed
US-20160016927-A1 DIHYDROBENZOFURAN DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-01-21 — — US disclosed
EP-2964025-A1 DIHYDROBENZOFURAN DERIVATIVES AS INSECTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2016-01-13 — — EP disclosed
WO-2014135095-A1 DIHYDROBENZOFURAN DERIVATIVES AS INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-09-12 — — 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-20160016927-A1 DIHYDROBENZOFURAN DERIVATIVES AS INSECTICIDAL COMPOUNDS DDT, DHODH, ACHE PNMT 763/4885ADRA2A 1479/4885MEN1 3500/4885

“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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