SCHEMBL684560

SCHEMBL684560

C/C(=N\NC(=O)c1ccccc1Cl)c1cc(Cl)cc(Cl)c1O

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
LMNA P02545 1/20 0.57
GAA P10253 1/20 0.57
MAPT P10636 3/20 0.56
AGTR1 P30556 1/20 0.56
OPRK1 P41145 1/20 0.56
CYP3A4 P08684 2/20 0.54
KDM1A O60341 2/20 0.53
KDM4E B2RXH2 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.50
NPC1 O15118 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
RAB9A P51151 1/20 0.46
POLB P06746 1/20 0.44

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
SCHEMBL684689 0.92 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL685082 0.91 KDM1A (0.58) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL684513 0.90 KMT2A (0.55) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL684768 0.89 SMN1; SMN2 (0.55) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL684551 0.87 KDM1A (0.70) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL684920 0.87 SMN1; SMN2 (0.52) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL685054 0.86 MAPT (0.61) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL684079 0.86 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL685158 0.85 GPR39 (0.59) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL683783 0.85 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2MEN1KMT2ALMNA

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 ALDH1A1 127/4885SMN1; SMN2 4107/4885MEN1 536/4885

“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.