SCHEMBL124351

SCHEMBL124351

CCN(C)c1nc2nc(C(F)(F)F)c(C(=O)O)cc2cc1F

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 1/20 0.34
GFER P55789 1/20 0.33
ATF1 P18846 1/20 0.32
NFKB1 P19838 1/20 0.32
ABCC1 P33527 1/20 0.32
KDM4E B2RXH2 3/20 0.31
NPSR1 Q6W5P4 1/20 0.31
EGLN1 Q9GZT9 3/20 0.31
FABP4 P15090 1/20 0.31
FABP5 Q01469 1/20 0.31
SLC16A3 O15427 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
SLC16A1 P53985 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
KEAP1 Q14145 1/20 0.30
NFE2L2 Q16236 1/20 0.30

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
SCHEMBL124072 0.89 KDM4E (0.36) MDM2GFERATF1NFKB1ABCC1
SCHEMBL124476 0.87 GFER (0.36) GFERATF1NFKB1ALDH1A1HPGD
SCHEMBL125223 0.86 KDM4E (0.46) ATF1NFKB1KDM4ENPSR1ALDH1A1
SCHEMBL124056 0.85 DGAT1 (0.37) GFEREGLN1
SCHEMBL122661 0.80 GABRP (0.36) GFERNFKB1KDM4ENPSR1KEAP1
SCHEMBL126280 0.78 GFER (0.43) GFERKDM4ENPSR1ALDH1A1KEAP1
SCHEMBL126379 0.78 GFER (0.38) GFERNFKB1KDM4EKEAP1NFE2L2
SCHEMBL126176 0.77 KDM4E (0.39) MDM2GFERATF1NFKB1KDM4E
SCHEMBL122906 0.77 GFER (0.34) GFERKDM4ENPSR1ALDH1A1KEAP1
SCHEMBL124490 0.76 KDM4E (0.47) ATF1NFKB1KDM4ENPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461083-B2 Herbicidal compounds SYNGENTA LIMITED (GB) 2013-06-11 US disclosed
EP-2265120-B1 HERBICIDAL COUMPOUNDS SYNGENTA LTD (GB) 2012-03-07 EP disclosed
CN-102006777-A Herbicidal coumpounds SYNGENTA LTD 2011-04-06 CN disclosed
US-20110021352-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-01-27 US disclosed
EP-2265120-A1 HERBICIDAL COUMPOUNDS Syngenta Limited (GB) 2010-12-29 EP disclosed
WO-2009115788-A1 HERBICIDAL COUMPOUNDS SYNGENTA LIMITED (GB) 2009-09-24 WO 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-20110021352-A1 HERBICIDAL COMPOUNDS RDX, NQO2, DDT MDM2 1248/4885GFER 986/4885ATF1 3837/4885

“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.