SCHEMBL684472

SCHEMBL684472

C/C(=N\NC(=O)Cc1ccc(F)cc1)c1cc(Cl)cc(Cl)c1O

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.58
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
ALDH1A1 P00352 3/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MITF O75030 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
OPRK1 P41145 1/20 0.46
HTT P42858 1/20 0.46
MAPT P10636 2/20 0.42
KDM1A O60341 1/20 0.40
EGFR P00533 1/20 0.40
ERBB2 P04626 1/20 0.40

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
SCHEMBL684514 0.88 MEN1 (0.61) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL684512 0.88 MEN1 (0.53) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL683726 0.83 KDM1A (0.55) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL685187 0.75 MEN1 (0.61) MEN1KMT2AALDH1A1LMNAKDM4E
SCHEMBL684917 0.75 KDM1A (0.61) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL684551 0.74 KDM1A (0.70) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL684689 0.74 ALDH1A1 (0.54) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL683865 0.73 KDM1A (0.55) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL685046 0.73 KDM1A (0.52) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL683780 0.72 KDM1A (0.60) SMN1; SMN2MEN1KMT2AALDH1A1LMNA

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 1 patent. 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

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 SMN1; SMN2 4107/4885MEN1 536/4885KMT2A 1362/4885

“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.