SCHEMBL685128

SCHEMBL685128

COc1ccc(C(=O)N/N=C(\C)c2cc(C)ccc2O)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.56
MAPT P10636 8/20 0.55
CYP1A2 P05177 1/20 0.55
NPC1 O15118 5/20 0.54
RAB9A P51151 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
KDM1A O60341 2/20 0.54
KLF10 Q13118 1/20 0.53
LMNA P02545 1/20 0.53
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 2/20 0.50
PSMD14 O00487 1/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 2/20 0.48
MIF P14174 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
SCHEMBL684584 0.93 KDM1A (0.54) GAAMAPTCYP1A2NPC1RAB9A
SCHEMBL684598 0.90 KDM1A (0.61) GAAMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL685351 0.86 GAA (0.55) GAAMAPTCYP1A2NPC1RAB9A
SCHEMBL684840 0.86 KDM1A (0.73) GAAMAPTCYP1A2NPC1RAB9A
SCHEMBL13568924 0.86 KDM1A (0.55) GAAMAPTCYP1A2NPC1RAB9A
SCHEMBL684993 0.85 MAPT (0.61) GAAMAPTCYP1A2NPC1RAB9A
SCHEMBL683934 0.85 KDM1A (0.70) GAAMAPTCYP1A2NPC1RAB9A
SCHEMBL685135 0.85 RAB9A (0.57) GAAMAPTCYP1A2NPC1RAB9A
SCHEMBL10166009 0.84 MAPT (0.56) GAAMAPTCYP1A2NPC1RAB9A
SCHEMBL683850 0.84 MAPT (0.58) GAAMAPTNPC1RAB9ASMN1; SMN2

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 GAA 670/4885MAPT 1491/4885CYP1A2 11/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 GAA 386/4885MAPT 921/4885CYP1A2 12/4885

“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.