SCHEMBL685011

SCHEMBL685011

Cc1cc(Cl)c(O)c(/C=N/NC(=O)c2ccc(F)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.61
NPC1 O15118 5/20 0.61
MAPT P10636 3/20 0.61
GAA P10253 1/20 0.58
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
KDM4E B2RXH2 3/20 0.58
TDP1 Q9NUW8 2/20 0.58
USP2 O75604 1/20 0.58
MCOLN3 Q8TDD5 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
SIRT1 Q96EB6 2/20 0.57
PIK3CG P48736 1/20 0.55
LMNA P02545 3/20 0.53
HTT P42858 3/20 0.53
PSMD14 O00487 2/20 0.53
MMP2 P08253 2/20 0.53
SMN1; SMN2 Q16637 4/20 0.52
GFER P55789 1/20 0.52
HPGD P15428 1/20 0.50

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
SCHEMBL683936 0.91 KMT2A (0.64) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL684977 0.89 KDM4E (0.59) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL684716 0.88 NPC1 (0.67) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL684848 0.87 NPC1 (0.75) RAB9ANPC1MAPTGAAMEN1
SCHEMBL684609 0.85 MAPT (0.58) RAB9ANPC1MAPTGAAMEN1
SCHEMBL26974381 0.84 PSMD14 (0.61) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL684599 0.84 PIK3CG (0.57) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL684490 0.84 KMT2A (0.73) RAB9ANPC1MAPTGAAMEN1
SCHEMBL26974387 0.84 PSMD14 (0.56) RAB9ANPC1MAPTMEN1KMT2A
SCHEMBL9921127 0.83 SIRT1 (0.61) RAB9ANPC1MAPTGAAMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-06-14 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-20120148682-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.