SCHEMBL685254

SCHEMBL685254

COc1cccc(/C(C)=N/NC(=O)c2ccccc2C)c1O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
KCNK3 O14649 1/20 0.51
POLB P06746 1/20 0.51
KCNK9 Q9NPC2 1/20 0.51
ATM Q13315 1/20 0.51
RAB9A P51151 4/20 0.51
SMN1; SMN2 Q16637 4/20 0.47
KDM4E B2RXH2 3/20 0.47
GAA P10253 2/20 0.47
NPC1 O15118 2/20 0.47
KDM1A O60341 1/20 0.47
MAPT P10636 3/20 0.47
HTT P42858 3/20 0.47
MEN1 O00255 1/20 0.45
TAS1R3 Q7RTX0 1/20 0.45
TAS1R1 Q7RTX1 1/20 0.45
ALDH1A1 P00352 1/20 0.45

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
SCHEMBL684020 0.88 KDM1A (0.58) KMT2APOLBATMRAB9ASMN1; SMN2
SCHEMBL684593 0.87 NPC1 (0.60) KMT2AKCNK3KCNK9RAB9ASMN1; SMN2
SCHEMBL685358 0.86 ATM (0.48) KMT2AKCNK3POLBKCNK9ATM
SCHEMBL684926 0.86 CYP3A4 (0.55) KMT2APOLBRAB9ASMN1; SMN2KDM4E
SCHEMBL684678 0.86 RAB9A (0.60) KMT2ARAB9ASMN1; SMN2KDM4EGAA
SCHEMBL685003 0.85 RAB9A (0.56) KMT2ARAB9ASMN1; SMN2KDM4EGAA
SCHEMBL19283317 0.83 KDM1A (0.65) POLBRAB9ASMN1; SMN2KDM4EGAA
SCHEMBL19283315 0.83 KDM1A (0.65) POLBRAB9ASMN1; SMN2KDM4EGAA
SCHEMBL684707 0.82 RAB9A (0.58) KMT2AKCNK3POLBKCNK9RAB9A
SCHEMBL684673 0.82 GAA (0.57) RAB9ASMN1; SMN2KDM4EGAANPC1

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 KMT2A 1362/4885KCNK3 640/4885POLB 4572/4885
US-20120021066-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 KMT2A 1224/4885KCNK3 635/4885POLB 4241/4885

“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.