SCHEMBL684701

SCHEMBL684701

C/C(=N\NC(=O)c1ccc(Br)cc1)c1cc(Cl)ccc1O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 9/20 0.77
RAB9A P51151 3/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
HTT P42858 2/20 0.59
NPC1 O15118 2/20 0.59
MAPT P10636 1/20 0.59
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
KDM4E B2RXH2 1/20 0.57
PSMD14 O00487 1/20 0.57
LMNA P02545 1/20 0.57
POLB P06746 1/20 0.57
MMP2 P08253 1/20 0.57
BLM P54132 1/20 0.57
CYP3A4 P08684 4/20 0.56
CYP2C19 P33261 4/20 0.56
CYP1A2 P05177 3/20 0.56
NFKB1 P19838 1/20 0.56
CASP3 P42574 1/20 0.56
NFKB2 Q00653 1/20 0.56

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
SCHEMBL683907 0.92 KDM1A (0.69) KDM1ARAB9ASMN1; SMN2HTTNPC1
SCHEMBL685115 0.92 KDM1A (0.85) KDM1ARAB9ASMN1; SMN2HTTNPC1
SCHEMBL685081 0.90 KDM1A (0.62) KDM1ARAB9ASMN1; SMN2HTTNPC1
SCHEMBL685062 0.89 RAB9A (0.61) KDM1ARAB9ASMN1; SMN2NPC1MEN1
SCHEMBL684836 0.88 KDM1A (0.79) KDM1ARAB9ASMN1; SMN2HTTNPC1
SCHEMBL685059 0.87 KDM1A (1.00) KDM1ARAB9ASMN1; SMN2HTTNPC1
SCHEMBL15772966 0.87 KDM1A (1.00) KDM1ARAB9ASMN1; SMN2HTTNPC1
SCHEMBL14696901 0.86 KDM1A (0.68) KDM1ARAB9ASMN1; SMN2HTTNPC1
SCHEMBL14696900 0.86 KDM1A (0.68) KDM1ARAB9ASMN1; SMN2HTTNPC1
SCHEMBL685135 0.86 RAB9A (0.57) KDM1ARAB9ASMN1; SMN2HTTNPC1

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 484/4885RAB9A 3846/4885SMN1; SMN2 4107/4885

“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.