SCHEMBL684230

SCHEMBL684230

O=C(N/N=C/c1cccc(Cl)c1O)c1ccc(F)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.78
NPC1 O15118 9/20 0.78
MAPT P10636 4/20 0.78
SMN1; SMN2 Q16637 6/20 0.63
HTT P42858 3/20 0.63
KDM4E B2RXH2 2/20 0.63
MEN1 O00255 2/20 0.63
LMNA P02545 2/20 0.63
KMT2A Q03164 2/20 0.63
HPGD P15428 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.58
CD38 P28907 1/20 0.58
CYP1A2 P05177 2/20 0.55
CYP3A4 P08684 2/20 0.55
CYP2C19 P33261 2/20 0.55
ALDH1A1 P00352 1/20 0.55
TDP1 Q9NUW8 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
KDM1A O60341 1/20 0.53

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
SCHEMBL684231 0.90 RAB9A (0.76) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL6571417 0.90 RAB9A (0.76) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL6571415 0.90 RAB9A (0.76) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL684189 0.89 NPC1 (0.64) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL683996 0.88 RAB9A (0.81) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL684794 0.88 RAB9A (0.69) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL10053130 0.87 RAB9A (0.60) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL683963 0.84 NPC1 (0.65) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL684234 0.84 MAPT (0.60) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL12218443 0.83 CYP1A2 (0.77) RAB9ANPC1MAPTSMN1; SMN2HTT

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-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
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 RAB9A 3846/4885NPC1 1690/4885MAPT 1491/4885
US-20120009274-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 RAB9A 3616/4885NPC1 1052/4885MAPT 921/4885

“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.