SCHEMBL123997

SCHEMBL123997

O=C(O)c1cc2cccnc2nc1C(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.47
LMNA P02545 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NAPRT Q6XQN6 2/20 0.44
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
BLM P54132 1/20 0.41
AGER Q15109 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MCL1 Q07820 1/20 0.40
ALOX12 P18054 1/20 0.39
IDO1 P14902 1/20 0.37
PLEC Q15149 1/20 0.36

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
SCHEMBL27838090 0.80 TSHR (0.42) KDM4ELMNAALDH1A1MAPTL3MBTL1
SCHEMBL7278161 0.78 KDM4E (0.55) KDM4ELMNAMEN1KMT2ANAPRT
SCHEMBL352470 0.78 KDM4E (0.53) KDM4ELMNAMEN1KMT2ANAPRT
SCHEMBL125290 0.76 LMNA (0.51) KDM4ELMNAMEN1KMT2ANAPRT
SCHEMBL27836545 0.76 LMNA (0.56) KDM4ELMNAMEN1KMT2ANAPRT
SCHEMBL125418 0.76 KDM4E (0.47) KDM4ELMNAMEN1KMT2ANAPRT
SCHEMBL125592 0.76 ALDH1A1 (0.39) KDM4ELMNAMEN1KMT2AALDH1A1
SCHEMBL31585844 0.75 NAPRT (0.58) KDM4ELMNAMEN1KMT2ANAPRT
SCHEMBL3932427 0.75 NAPRT (0.58) KDM4ELMNAMEN1KMT2ANAPRT
SCHEMBL17942663 0.74 DHODH (0.51) KDM4ELMNAMEN1KMT2ANAPRT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102006777-B Herbicidal compounds SYNGENTA LTD 2015-04-01 CN disclosed
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 KDM4E 1231/4885LMNA 2087/4885MEN1 1810/4885

“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.