SCHEMBL684088

SCHEMBL684088

C/C(=N\NC(=O)c1cccc(C)c1)c1cc(F)cc(F)c1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 3/20 0.55
MAPT P10636 9/20 0.53
SMN1; SMN2 Q16637 6/20 0.53
ALDH1A1 P00352 4/20 0.53
NPC1 O15118 4/20 0.51
RAB9A P51151 3/20 0.51
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP2C9 P11712 1/20 0.47
LMNA P02545 3/20 0.46
POLB P06746 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 2/20 0.46
HTT P42858 2/20 0.46
GAA P10253 2/20 0.46
PKM P14618 1/20 0.46
MCL1 Q07820 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46

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
SCHEMBL684732 0.88 NPC1 (0.67) MTORMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL684092 0.87 KDM1A (0.54) MTORMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL685106 0.86 MAPT (0.54) MTORMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL685100 0.81 RAB9A (0.50) MTORMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL684742 0.81 KDM1A (0.54) MTORMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL685375 0.81 RAB9A (0.54) MTORMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL684913 0.80 MTOR (0.53) MTORMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL684749 0.79 KDM1A (0.53) MTORMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL683725 0.79 KDM1A (0.67) MTORMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL684595 0.79 MAPT (0.62) MTORMAPTSMN1; SMN2ALDH1A1NPC1

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 MTOR 2134/4885MAPT 1491/4885SMN1; SMN2 4107/4885
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 MTOR 2360/4885MAPT 921/4885SMN1; SMN2 3775/4885

“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.