SCHEMBL684697

SCHEMBL684697

C/C(=N\NC(=O)c1cccc(C)c1)c1cccc(Cl)c1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.55
SMN1; SMN2 Q16637 6/20 0.55
ALDH1A1 P00352 5/20 0.55
CYP3A4 P08684 1/20 0.52
KDM1A O60341 4/20 0.51
KCNK3 O14649 1/20 0.51
KCNK9 Q9NPC2 1/20 0.51
KDM4E B2RXH2 3/20 0.51
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
MTOR P42345 1/20 0.48
RAB9A P51151 4/20 0.47
HTT P42858 2/20 0.47
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
PKM P14618 1/20 0.47
KMT2A Q03164 1/20 0.47
MCL1 Q07820 1/20 0.47

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
SCHEMBL684029 0.89 KDM1A (0.58) MAPTSMN1; SMN2ALDH1A1CYP3A4KDM1A
SCHEMBL684916 0.88 KDM1A (0.55) MAPTSMN1; SMN2ALDH1A1CYP3A4KDM1A
SCHEMBL659320 0.88 KDM1A (0.55) MAPTSMN1; SMN2ALDH1A1CYP3A4KDM1A
SCHEMBL685108 0.87 CYP3A4 (0.57) MAPTSMN1; SMN2ALDH1A1CYP3A4KDM1A
SCHEMBL683714 0.87 CYP3A4 (0.64) MAPTSMN1; SMN2ALDH1A1CYP3A4KDM1A
SCHEMBL423694 0.87 CYP3A4 (0.64) MAPTSMN1; SMN2ALDH1A1CYP3A4KDM1A
SCHEMBL684707 0.84 RAB9A (0.58) MAPTSMN1; SMN2ALDH1A1KCNK3KCNK9
SCHEMBL10197491 0.84 MAPT (0.54) MAPTSMN1; SMN2ALDH1A1KDM1AKDM4E
SCHEMBL683725 0.83 KDM1A (0.67) MAPTSMN1; SMN2ALDH1A1KDM1AKDM4E
SCHEMBL684038 0.83 CYP3A4 (0.59) MAPTSMN1; SMN2ALDH1A1CYP3A4KDM1A

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-8476194-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES, LLC (US) 2013-07-02 US disclosed
US-8476194-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES, LLC (US) 2013-07-02 US disclosed
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-26 US disclosed
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-26 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

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 MAPT 1491/4885SMN1; SMN2 4107/4885ALDH1A1 127/4885
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 MAPT 921/4885SMN1; SMN2 3775/4885ALDH1A1 115/4885

“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.