SCHEMBL684775

SCHEMBL684775

O=C(N/N=C/c1c(O)cccc1Cl)c1cccc(F)c1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.85
CYP3A4 P08684 2/20 0.85
CYP2C19 P33261 2/20 0.85
RAB9A P51151 7/20 0.70
NPC1 O15118 6/20 0.70
SMN1; SMN2 Q16637 5/20 0.70
MAPT P10636 5/20 0.70
HPGD P15428 1/20 0.70
HTT P42858 1/20 0.70
CYP2D6 P10635 1/20 0.63
CYP2C9 P11712 1/20 0.63
KMT2A Q03164 6/20 0.55
MEN1 O00255 5/20 0.55
POLB P06746 2/20 0.55
KDM1A O60341 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
CTDSP1 Q9GZU7 1/20 0.54
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
APAF1 O14727 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
SCHEMBL12218408 0.92 CYP1A2 (1.00) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL685019 0.88 CYP1A2 (0.66) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL684205 0.88 CYP1A2 (0.81) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL684652 0.87 KDM1A (0.70) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL683982 0.86 CYP1A2 (0.63) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL684571 0.85 CYP1A2 (0.61) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL683996 0.82 RAB9A (0.81) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL683983 0.82 RAB9A (0.57) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL661128 0.82 RAB9A (0.57) CYP1A2CYP3A4CYP2C19RAB9ANPC1
SCHEMBL684970 0.81 DUSP3 (0.70) 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8906829-B2 Synergistic algicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES LLC (US) 2014-12-09 US disclosed
US-8906829-B2 Synergistic algicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES LLC (US) 2014-12-09 US disclosed
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-20120046170-A1 SYNERGISTIC ALGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-02-23 US disclosed
WO-2012024494-A1 SYNERGISTIC ALGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-02-23 WO disclosed
US-20120046170-A1 SYNERGISTIC ALGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-02-23 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 (3 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
US-20120046170-A1 SYNERGISTIC ALGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER ALG1, SOD1, DHPS CYP1A2 1110/4885CYP3A4 2091/4885CYP2C19 2087/4885

“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.