SCHEMBL9921093

SCHEMBL9921093

Cc1ccc(C(=O)N/N=C/c2cc(C(F)(F)F)cc(C(F)(F)F)c2O)cc1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 5/20 0.63
ALOX5 P09917 4/20 0.58
PTGS2 P35354 4/20 0.58
MAPT P10636 3/20 0.56
NPC1 O15118 3/20 0.54
RAB9A P51151 2/20 0.54
PKM P14618 1/20 0.54
ATM Q13315 1/20 0.54
LMNA P02545 2/20 0.51
PHGDH O43175 1/20 0.50
KDM4E B2RXH2 2/20 0.49
HTT P42858 2/20 0.48
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
POLB P06746 1/20 0.48
PTBP1 P26599 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 1/20 0.46
MITF O75030 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
SCHEMBL684720 0.91 SIRT1 (0.62) SIRT1ALOX5PTGS2MAPTNPC1
SCHEMBL9921033 0.91 SIRT1 (0.62) SIRT1ALOX5PTGS2MAPTNPC1
SCHEMBL686471 0.88 SIRT1 (0.60) SIRT1ALOX5PTGS2MAPTNPC1
SCHEMBL9921031 0.88 ALOX5 (0.71) SIRT1ALOX5PTGS2MAPTNPC1
SCHEMBL686245 0.88 ALOX5 (0.58) SIRT1ALOX5PTGS2MAPTNPC1
SCHEMBL684644 0.87 SIRT1 (0.59) SIRT1ALOX5PTGS2MAPTNPC1
SCHEMBL685264 0.87 SIRT1 (0.61) SIRT1ALOX5PTGS2MAPTNPC1
SCHEMBL9921125 0.85 PIK3CG (0.60) SIRT1ALOX5PTGS2MAPTPKM
SCHEMBL685015 0.85 RAB9A (0.55) SIRT1ALOX5PTGS2MAPTNPC1
SCHEMBL686445 0.84 PHGDH (0.69) SIRT1ALOX5PTGS2MAPTNPC1

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-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-06-14 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-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 SIRT1 1977/4885ALOX5 1904/4885PTGS2 2914/4885

“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.