SCHEMBL686337

SCHEMBL686337

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.55
LMNA P02545 5/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
HTT P42858 4/20 0.55
KDM4E B2RXH2 4/20 0.55
TDP1 Q9NUW8 3/20 0.55
POLB P06746 3/20 0.55
PTBP1 P26599 1/20 0.55
MAPT P10636 7/20 0.51
MEN1 O00255 3/20 0.51
PIK3CG P48736 1/20 0.51
SIRT1 Q96EB6 1/20 0.50
ALOX5 P09917 1/20 0.49
PTGS2 P35354 1/20 0.49
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
HPGD P15428 1/20 0.49
USP2 O75604 1/20 0.48
MCOLN3 Q8TDD5 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL9921139 0.89 KDM1A (0.61) KMT2ALMNASMN1; SMN2HTTKDM4E
SCHEMBL686245 0.88 ALOX5 (0.58) KMT2ALMNASMN1; SMN2HTTKDM4E
SCHEMBL9921039 0.88 MAPT (0.65) KMT2ALMNASMN1; SMN2HTTKDM4E
SCHEMBL685264 0.88 SIRT1 (0.61) KMT2ALMNASMN1; SMN2HTTKDM4E
SCHEMBL9921134 0.88 ALOX5 (0.60) KMT2ALMNASMN1; SMN2HTTKDM4E
SCHEMBL684599 0.87 PIK3CG (0.57) KMT2ALMNASMN1; SMN2HTTKDM4E
SCHEMBL684785 0.85 PIK3CG (0.68) KMT2ALMNASMN1; SMN2HTTKDM4E
SCHEMBL686334 0.84 DUSP3 (0.61) KMT2ALMNASMN1; SMN2HTTKDM4E
SCHEMBL686260 0.84 KDM4E (0.68) KMT2ALMNASMN1; SMN2HTTKDM4E
SCHEMBL9921127 0.83 SIRT1 (0.61) KMT2ALMNASMN1; SMN2HTTKDM4E

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 KMT2A 1362/4885LMNA 4808/4885SMN1; SMN2 4107/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 KMT2A 1224/4885LMNA 4567/4885SMN1; SMN2 3775/4885

“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.