SCHEMBL685054

SCHEMBL685054

C/C(=N\NC(=O)c1ccccc1Cl)c1cccc(Cl)c1O

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.61
AGTR1 P30556 2/20 0.61
MEN1 O00255 1/20 0.61
OPRK1 P41145 1/20 0.61
KMT2A Q03164 1/20 0.61
ALDH1A1 P00352 4/20 0.60
CYP3A4 P08684 2/20 0.59
KDM4E B2RXH2 2/20 0.57
SMN1; SMN2 Q16637 5/20 0.52
NPC1 O15118 5/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
KDM1A O60341 2/20 0.49
POLB P06746 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
ATM Q13315 1/20 0.47
RAB9A P51151 4/20 0.47
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 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
SCHEMBL684699 0.92 KDM1A (0.57) MAPTAGTR1MEN1OPRK1KMT2A
SCHEMBL684694 0.90 KMT2A (0.56) MAPTAGTR1MEN1OPRK1KMT2A
SCHEMBL685058 0.89 NPC1 (0.59) MAPTAGTR1MEN1OPRK1KMT2A
SCHEMBL423694 0.89 CYP3A4 (0.64) MAPTAGTR1MEN1OPRK1KMT2A
SCHEMBL683714 0.89 CYP3A4 (0.64) MAPTAGTR1MEN1OPRK1KMT2A
SCHEMBL684926 0.87 CYP3A4 (0.55) MAPTAGTR1MEN1OPRK1KMT2A
SCHEMBL684651 0.87 KDM1A (0.65) MAPTAGTR1MEN1OPRK1KMT2A
SCHEMBL684560 0.86 ALDH1A1 (0.57) MAPTAGTR1MEN1OPRK1KMT2A
SCHEMBL684674 0.85 ALDH1A1 (0.53) MAPTAGTR1MEN1OPRK1KMT2A
SCHEMBL684038 0.85 CYP3A4 (0.59) MAPTAGTR1MEN1OPRK1KMT2A

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 1491/4885AGTR1 2691/4885MEN1 536/4885
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 MAPT 921/4885AGTR1 2704/4885MEN1 508/4885

“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.