SCHEMBL685268

SCHEMBL685268

Cc1cc(Cl)c(O)c(/C=N/NC(=O)c2ccccc2C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 4/20 0.54
KMT2A Q03164 8/20 0.48
MAPT P10636 7/20 0.48
HTT P42858 6/20 0.48
KDM4E B2RXH2 6/20 0.48
LMNA P02545 3/20 0.48
ALOX5 P09917 1/20 0.48
PTGS2 P35354 1/20 0.48
ALOX12 P18054 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PKM P14618 2/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 2/20 0.48
ATM Q13315 1/20 0.48
CD38 P28907 1/20 0.47
SIRT1 Q96EB6 1/20 0.46
MEN1 O00255 7/20 0.46
MAPK1 P28482 2/20 0.46
BLM P54132 1/20 0.46
TDP1 Q9NUW8 2/20 0.44

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
SCHEMBL684734 0.90 ALOX5 (0.54) PIK3CGKMT2AMAPTHTTKDM4E
SCHEMBL685152 0.89 PIK3CG (0.59) PIK3CGKMT2AMAPTHTTKDM4E
SCHEMBL686335 0.88 ALOX5 (0.52) PIK3CGKMT2AMAPTHTTKDM4E
SCHEMBL685013 0.85 PIK3CG (0.66) PIK3CGKMT2AMAPTHTTKDM4E
SCHEMBL685008 0.84 CD38 (0.58) KMT2AMAPTHTTKDM4ELMNA
SCHEMBL685291 0.83 KMT2A (0.51) PIK3CGKMT2AMAPTHTTKDM4E
SCHEMBL684666 0.83 PIK3CG (0.60) PIK3CGKMT2AMAPTHTTKDM4E
SCHEMBL683949 0.82 ALOX5 (0.64) PIK3CGKMT2AMAPTHTTKDM4E
SCHEMBL684748 0.81 NTRK1 (0.51) KMT2AMAPTHTTKDM4ELMNA
SCHEMBL684657 0.80 KMT2A (0.56) PIK3CGKMT2AMAPTHTTKDM4E

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 2876/4885KMT2A 1362/4885MAPT 1491/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 PIK3CG 2911/4885KMT2A 1224/4885MAPT 921/4885

“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.