SCHEMBL9921060

SCHEMBL9921060

O=C(N/N=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1O)c1ccccc1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.72
PTGS2 P35354 2/20 0.72
KMT2A Q03164 7/20 0.63
MEN1 O00255 6/20 0.63
HTT P42858 4/20 0.63
MAPT P10636 3/20 0.63
KDM4E B2RXH2 4/20 0.59
TDP1 Q9NUW8 3/20 0.59
MAPK1 P28482 2/20 0.59
TP53 P04637 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
HPGD P15428 1/20 0.59
HSD17B10 Q99714 1/20 0.59
NTRK1 P04629 3/20 0.57
LMNA P02545 2/20 0.54
PTBP1 P26599 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
POLB P06746 1/20 0.54
P2RX1 P51575 1/20 0.50

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
SCHEMBL685628 0.92 ALOX5 (0.60) ALOX5PTGS2KMT2AMEN1HTT
SCHEMBL685652 0.87 KMT2A (0.61) ALOX5PTGS2KMT2AMEN1HTT
SCHEMBL684960 0.87 ALOX5 (0.61) ALOX5PTGS2KMT2AMEN1HTT
SCHEMBL683949 0.87 ALOX5 (0.64) ALOX5PTGS2KMT2AMEN1HTT
SCHEMBL9921031 0.86 ALOX5 (0.71) ALOX5PTGS2KMT2AMEN1HTT
SCHEMBL9921125 0.85 PIK3CG (0.60) ALOX5PTGS2KMT2AMEN1HTT
SCHEMBL684627 0.84 KMT2A (0.67) ALOX5PTGS2KMT2AMEN1HTT
SCHEMBL686455 0.84 KMT2A (0.70) ALOX5PTGS2KMT2AMEN1HTT
SCHEMBL686335 0.82 ALOX5 (0.52) ALOX5PTGS2KMT2AMEN1HTT
SCHEMBL9921033 0.81 SIRT1 (0.62) ALOX5PTGS2KMT2AMEN1HTT

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-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-06-14 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 ALOX5 2022/4885PTGS2 2788/4885KMT2A 1362/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 ALOX5 1904/4885PTGS2 2914/4885KMT2A 1224/4885

“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.