SCHEMBL4215979

SCHEMBL4215979

O=C1CNC(c2cc(Cl)cc(Cl)c2)=NN1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
MAOB P27338 6/20 0.31
GAA P10253 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GFER P55789 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30
PGR P06401 1/20 0.30
AXL P30530 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
SCHEMBL10899939 0.83 PGR (0.42) MAOBPGR
SCHEMBL4215079 0.82 MAOB (0.43) MAOBGAAALDH1A1
SCHEMBL4211464 0.78 PDE3B (0.51) PDE3BPDE3AGAAALDH1A1
SCHEMBL22309145 0.75 PDE3B (0.42) PDE3BPDE3APGR
SCHEMBL4361638 0.74 AXL (0.52) PDE3BPDE3AMAOBGAAALDH1A1
SCHEMBL7355155 0.74 KCNH2 (0.44) PDE3BPDE3AGAAAXL
SCHEMBL22308341 0.73 MAPT (0.39) PDE3BPDE3AMAOBGAAAXL
SCHEMBL7284129 0.71 CYP3A4 (0.39) PDE3BPDE3AALDH1A1AXL
SCHEMBL12847195 0.70 AXL (0.56) PDE3BPDE3AMAOBGAAALDH1A1
SCHEMBL22309155 0.69 PDE3B (0.47) PDE3BPDE3A

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 5 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
EP-1337150-A4 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) 2007-09-26 EP 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
EP-1337150-A2 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) 2003-08-27 EP disclosed
WO-2002067675-A2 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) 2002-09-06 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-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 PDE3B 997/4885PDE3A 815/4885MAOB 1482/4885

“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.