SCHEMBL684945

SCHEMBL684945

Cc1ccc(C(=O)N/N=C/c2cc(C)cc(C(F)(F)F)c2O)c(O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 5/20 0.62
ALOX5 P09917 1/20 0.50
PTGS2 P35354 1/20 0.50
MAPT P10636 6/20 0.45
KMT2A Q03164 5/20 0.45
MEN1 O00255 4/20 0.45
HTT P42858 4/20 0.45
LMNA P02545 3/20 0.45
KDM4E B2RXH2 3/20 0.45
MAPK1 P28482 2/20 0.45
BLM P54132 1/20 0.45
SIRT1 Q96EB6 2/20 0.45
PKM P14618 2/20 0.44
GCGR P47871 1/20 0.43
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL9921125 0.91 PIK3CG (0.60) PIK3CGALOX5PTGS2MAPTKMT2A
SCHEMBL683972 0.90 PIK3CG (0.74) PIK3CGALOX5PTGS2MAPTKMT2A
SCHEMBL683949 0.89 ALOX5 (0.64) PIK3CGALOX5PTGS2MAPTKMT2A
SCHEMBL684633 0.88 PIK3CG (0.67) PIK3CGALOX5PTGS2MAPTKMT2A
SCHEMBL684734 0.85 ALOX5 (0.54) PIK3CGALOX5PTGS2MAPTKMT2A
SCHEMBL684720 0.85 SIRT1 (0.62) ALOX5PTGS2MAPTKMT2AMEN1
SCHEMBL684718 0.82 PIK3CG (0.84) PIK3CGMAPTKMT2AMEN1HTT
SCHEMBL684614 0.82 LMNA (0.53) ALOX5PTGS2MAPTKMT2AMEN1
SCHEMBL685300 0.81 PIK3CG (0.83) PIK3CGMAPTKMT2AMEN1HTT
SCHEMBL685251 0.81 ALOX5 (0.63) ALOX5PTGS2MAPTKMT2AHTT

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 PIK3CG 2876/4885ALOX5 2022/4885PTGS2 2788/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 PIK3CG 2911/4885ALOX5 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.