SCHEMBL685255

SCHEMBL685255

COc1cccc(/C(C)=N/NC(=O)c2cccc(Cl)c2)c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 5/20 0.55
GRM5 P41594 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
POLB P06746 2/20 0.50
GAA P10253 1/20 0.50
CASP6 P55212 1/20 0.50
RAB9A P51151 4/20 0.49
MAPT P10636 3/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
HTT P42858 1/20 0.49
NPC1 O15118 3/20 0.48
ATM Q13315 1/20 0.47
MTOR P42345 1/20 0.46

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
SCHEMBL685094 0.89 KDM1A (0.51) KDM1AGRM5SMN1; SMN2CYP1A2CYP3A4
SCHEMBL684710 0.88 LMNA (0.55) KDM1ASMN1; SMN2CYP1A2CYP3A4MEN1
SCHEMBL684707 0.87 RAB9A (0.58) SMN1; SMN2CYP1A2MEN1KMT2APOLB
SCHEMBL684029 0.86 KDM1A (0.58) KDM1ASMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL684593 0.86 NPC1 (0.60) KDM1ASMN1; SMN2CYP1A2CYP3A4MEN1
SCHEMBL684926 0.83 CYP3A4 (0.55) KDM1ASMN1; SMN2CYP3A4MEN1KMT2A
SCHEMBL19283315 0.83 KDM1A (0.65) KDM1ASMN1; SMN2POLBGAARAB9A
SCHEMBL684771 0.83 KDM1A (0.70) KDM1ASMN1; SMN2CYP1A2CYP3A4CYP2D6
SCHEMBL19283317 0.83 KDM1A (0.65) KDM1ASMN1; SMN2POLBGAARAB9A
SCHEMBL685003 0.81 RAB9A (0.56) KDM1ASMN1; SMN2CYP1A2CYP3A4MEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476194-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES, LLC (US) 2013-07-02 US disclosed
US-8476194-B2 Fungicidal compositions including hydrazone derivatives and copper DOW AGROSCIENCES, LLC (US) 2013-07-02 US disclosed
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-26 US disclosed
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-26 US disclosed
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 (2 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 484/4885GRM5 999/4885SMN1; SMN2 4107/4885
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 KDM1A 291/4885GRM5 1638/4885SMN1; SMN2 3775/4885

“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.