SCHEMBL685019

SCHEMBL685019

O=C(N/N=C/c1c(O)cccc1Cl)c1ccc(F)cc1

nearest known ligand 0.84

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.66
CYP3A4 P08684 1/20 0.66
CYP2C19 P33261 1/20 0.66
NPC1 O15118 6/20 0.65
RAB9A P51151 5/20 0.65
MAPT P10636 2/20 0.65
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
KDM1A O60341 2/20 0.56
TDP1 Q9NUW8 2/20 0.54
HPGD P15428 1/20 0.53
HTT P42858 1/20 0.53
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA9 Q16790 1/20 0.52
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50

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
SCHEMBL12218443 0.92 CYP1A2 (0.77) CYP1A2CYP3A4CYP2C19NPC1RAB9A
SCHEMBL683983 0.90 RAB9A (0.57) CYP1A2CYP3A4CYP2C19NPC1RAB9A
SCHEMBL661128 0.90 RAB9A (0.57) CYP1A2CYP3A4CYP2C19NPC1RAB9A
SCHEMBL684571 0.89 CYP1A2 (0.61) CYP1A2CYP3A4CYP2C19NPC1RAB9A
SCHEMBL684775 0.88 CYP1A2 (0.85) CYP1A2CYP3A4CYP2C19NPC1RAB9A
SCHEMBL684969 0.88 KDM1A (0.61) CYP1A2CYP3A4CYP2C19NPC1RAB9A
SCHEMBL10053112 0.87 KDM1A (0.54) CYP1A2CYP3A4CYP2C19NPC1RAB9A
SCHEMBL683990 0.84 MAPT (0.56) CYP1A2CYP3A4CYP2C19NPC1RAB9A
SCHEMBL684208 0.83 RAB9A (0.60) CYP1A2CYP3A4CYP2C19NPC1RAB9A
SCHEMBL684652 0.83 KDM1A (0.70) CYP1A2CYP3A4CYP2C19NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8715745-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES, LLC. (US) 2014-05-06 US disclosed
US-8715745-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES, LLC. (US) 2014-05-06 US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 US disclosed
US-20120009274-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 US disclosed
US-20120009274-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 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 (2 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-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, SOD3 CYP1A2 11/4885CYP3A4 48/4885CYP2C19 138/4885
US-20120009274-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 CYP1A2 12/4885CYP3A4 71/4885CYP2C19 120/4885

“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.