SCHEMBL686245

SCHEMBL686245

Cc1cccc(C(=O)N/N=C/c2cc(C(F)(F)F)cc(C(F)(F)F)c2O)c1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.58
PTGS2 P35354 4/20 0.58
LMNA P02545 4/20 0.56
KMT2A Q03164 3/20 0.56
POLB P06746 3/20 0.56
KDM4E B2RXH2 3/20 0.56
HTT P42858 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
PTBP1 P26599 1/20 0.56
MAPT P10636 6/20 0.52
MEN1 O00255 1/20 0.52
SIRT1 Q96EB6 1/20 0.51
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
PKM P14618 1/20 0.48
ATM Q13315 1/20 0.48
KCNK3 O14649 1/20 0.46
KCNK9 Q9NPC2 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
SCHEMBL684614 0.91 LMNA (0.53) ALOX5PTGS2LMNAKMT2APOLB
SCHEMBL683970 0.88 PIK3CG (0.51) ALOX5PTGS2LMNAKMT2APOLB
SCHEMBL686337 0.88 KMT2A (0.55) ALOX5PTGS2LMNAKMT2APOLB
SCHEMBL685684 0.88 KMT2A (0.57) ALOX5PTGS2LMNAKMT2APOLB
SCHEMBL9921093 0.88 SIRT1 (0.63) ALOX5PTGS2LMNAKMT2APOLB
SCHEMBL685269 0.88 RAB9A (0.57) ALOX5PTGS2LMNAKMT2APOLB
SCHEMBL9921031 0.88 ALOX5 (0.71) ALOX5PTGS2LMNAKMT2APOLB
SCHEMBL9921041 0.87 KDM1A (0.60) ALOX5PTGS2LMNAKMT2APOLB
SCHEMBL686260 0.84 KDM4E (0.68) LMNAKMT2APOLBKDM4EHTT
SCHEMBL686244 0.83 DUSP3 (0.62) ALOX5PTGS2LMNAKMT2APOLB

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 2788/4885LMNA 4808/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 ALOX5 1904/4885PTGS2 2914/4885LMNA 4567/4885

“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.