SCHEMBL684974

SCHEMBL684974

O=C(N/N=C/c1c(Cl)ccc(Cl)c1O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C19 P33261 1/20 0.56
RAB9A P51151 4/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
NPC1 O15118 3/20 0.52
ESRRG P62508 1/20 0.52
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
MAPT P10636 3/20 0.51
ALDH1A1 P00352 3/20 0.51
TDP1 Q9NUW8 3/20 0.51
KDM4E B2RXH2 2/20 0.51
MAPK1 P28482 2/20 0.51
LMNA P02545 2/20 0.51
TP53 P04637 1/20 0.51
HSP90AA1 P07900 1/20 0.51
GAA P10253 1/20 0.51
TNNI3 P19429 1/20 0.51
HTT P42858 1/20 0.51

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
SCHEMBL684935 0.88 MAPT (0.53) CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2
SCHEMBL684752 0.88 RAB9A (0.56) RAB9ASMN1; SMN2NPC1MEN1KMT2A
SCHEMBL684208 0.87 RAB9A (0.60) CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2
SCHEMBL684892 0.86 KDM1A (0.63) CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2
SCHEMBL683966 0.86 MAPT (0.58) CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2
SCHEMBL684571 0.84 CYP1A2 (0.61) CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2
SCHEMBL684888 0.84 CYP1A2 (0.58) CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2
SCHEMBL684205 0.84 CYP1A2 (0.81) CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2
SCHEMBL684957 0.83 KMT2A (0.61) CYP3A4RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL684572 0.83 NPC1 (0.54) CYP1A2CYP3A4CYP2C19RAB9ASMN1; SMN2

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.