SCHEMBL684757

SCHEMBL684757

CC/C(=N\NC(=O)c1ccccc1)c1cc(Cl)cc(Cl)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.54
ALDH1A1 P00352 6/20 0.52
MAPT P10636 5/20 0.52
KDM4E B2RXH2 2/20 0.52
SMN1; SMN2 Q16637 6/20 0.50
RAB9A P51151 4/20 0.50
LMNA P02545 2/20 0.50
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
GAA P10253 1/20 0.46
NPC1 O15118 3/20 0.46
POLB P06746 1/20 0.45
STK39 Q9UEW8 2/20 0.44
AKR1C4 P17516 1/20 0.44
AKR1C3 P42330 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
PARG Q86W56 1/20 0.44
GSTA1 P08263 1/20 0.44
GLA P06280 1/20 0.43

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
SCHEMBL684551 0.85 KDM1A (0.70) KDM1AALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL685113 0.81 KDM1A (0.53) KDM1AALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL684094 0.81 KDM1A (0.49) KDM1AALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL14399940 0.80 KDM1A (0.57) KDM1AALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL14370954 0.79 KDM1A (0.56) KDM1AALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL684755 0.79 KDM1A (0.50) KDM1AALDH1A1SMN1; SMN2RAB9ALMNA
SCHEMBL685189 0.77 GSTA1 (0.68) KDM1AALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL684917 0.75 KDM1A (0.61) KDM1AALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL683780 0.75 KDM1A (0.60) KDM1AALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL684918 0.75 MTOR (0.61) KDM1AALDH1A1MAPTSMN1; SMN2RAB9A

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-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 (1 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 KDM1A 484/4885ALDH1A1 127/4885MAPT 1491/4885

“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.