SCHEMBL683726

SCHEMBL683726

C/C(=N\NC(=O)c1ccc(F)cc1)c1cc(Cl)cc(Cl)c1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.50
MEN1 O00255 2/20 0.50
ALDH1A1 P00352 2/20 0.50
KMT2A Q03164 2/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA4 P22748 2/20 0.48
CA9 Q16790 2/20 0.48
NPC1 O15118 5/20 0.48
RAB9A P51151 4/20 0.48
MAPT P10636 3/20 0.47
CYP2C9 P11712 1/20 0.47
CYP3A4 P08684 1/20 0.47
AGTR1 P30556 1/20 0.47
MTOR P42345 1/20 0.46
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 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
SCHEMBL684917 0.92 KDM1A (0.61) KDM1ASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL683865 0.90 KDM1A (0.55) KDM1ASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL685046 0.89 KDM1A (0.52) KDM1ASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL684919 0.89 MEN1 (0.54) KDM1ASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL684551 0.88 KDM1A (0.70) KDM1ASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL13285465 0.87 KDM1A (0.50) KDM1ASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL685324 0.86 GAA (0.54) KDM1ASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL683780 0.84 KDM1A (0.60) KDM1ASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL684472 0.83 SMN1; SMN2 (0.58) KDM1ASMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL659320 0.81 KDM1A (0.55) KDM1ASMN1; SMN2MEN1ALDH1A1KMT2A

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 484/4885SMN1; 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.