SCHEMBL684601

SCHEMBL684601

C/C(=N\NC(=O)Cc1ccccc1)c1ccccc1O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.80
MEN1 O00255 5/20 0.80
DUSP3 P51452 1/20 0.62
PTPN5 P54829 1/20 0.62
PTPN11 Q06124 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
KDM4E B2RXH2 7/20 0.61
CYP1A2 P05177 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
HTT P42858 3/20 0.58
LMNA P02545 2/20 0.58
GAA P10253 1/20 0.57
MAPK1 P28482 1/20 0.57
OXTR P30559 1/20 0.56
NPC1 O15118 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
KDM1A O60341 1/20 0.56
MAPT P10636 1/20 0.53

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
SCHEMBL684602 0.86 KDM4E (0.65) KMT2AMEN1DUSP3PTPN5PTPN11
SCHEMBL23701490 0.78 KDM1A (0.74) KMT2AMEN1DUSP3PTPN5PTPN11
SCHEMBL684855 0.78 KDM1A (0.74) KMT2AMEN1DUSP3PTPN5PTPN11
SCHEMBL684514 0.78 MEN1 (0.61) KMT2AMEN1KDM4ECYP1A2CYP2D6
SCHEMBL684658 0.77 KDM1A (0.83) KMT2AMEN1KDM4ECYP1A2CYP2C19
SCHEMBL12218528 0.75 KDM4E (0.57) KMT2AMEN1DUSP3PTPN5PTPN11
SCHEMBL10807644 0.74 LMNA (0.81) KMT2AMEN1KDM4ECYP1A2CYP2D6
SCHEMBL15354266 0.73 KDM4E (0.56) KMT2AMEN1KDM4ECYP1A2CYP2C19
SCHEMBL31001114 0.73 GAA (0.65) KMT2AMEN1DUSP3PTPN5PTPN11
SCHEMBL17637926 0.73 CYP1A2 (0.55) KMT2AMEN1KDM4ECYP1A2CYP2D6

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 KMT2A 1362/4885MEN1 536/4885DUSP3 858/4885

“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.