SCHEMBL923307

SCHEMBL923307

Nc1ncccc1C(=O)NCc1ccc(OCc2cc(F)cc(F)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
LMNA P02545 2/20 0.48
MAPT P10636 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PDPK1 O15530 1/20 0.46
EGLN1 Q9GZT9 1/20 0.46
MAPK8 P45983 1/20 0.46
HDAC1 Q13547 1/20 0.46
MEN1 O00255 1/20 0.45
GSK3B P49841 1/20 0.45
BACE1 P56817 1/20 0.45

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
SCHEMBL1680671 0.92 MAOB (0.54)
SCHEMBL12352271 0.91 KMT2A (0.59) KMT2ALMNAMAPTL3MBTL1HPGD
SCHEMBL1681107 0.91 KMT2A (0.59) KMT2ALMNAMAPTL3MBTL1HPGD
SCHEMBL921923 0.87 EGLN1 (0.57) KMT2APDPK1EGLN1MAPK8
SCHEMBL922540 0.86 MAPK8 (0.58) KMT2ALMNAMAPTL3MBTL1HPGD
SCHEMBL12352268 0.86 KMT2A (0.50) KMT2ALMNAMAPTL3MBTL1HPGD
SCHEMBL922058 0.85 MAPK8 (0.59) KMT2ALMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL922511 0.84 HPGD (0.60) LMNAMAPTHPGDSMN1; SMN2EGLN1
SCHEMBL921980 0.84 HPGD (0.64) KMT2ALMNAMAPTHPGDSMN1; SMN2
SCHEMBL920343 0.84 KMT2A (0.61) KMT2ALMNAMAPTL3MBTL1HPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP 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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 KMT2A 2469/4885LMNA 4812/4885MAPT 695/4885

“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.