SCHEMBL17596193

SCHEMBL17596193

COC(=O)c1cc2cccnc2c(Br)c1C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.48
ALOX15 P16050 1/20 0.46
HTT P42858 1/20 0.46
ALDH1A1 P00352 4/20 0.45
SLC40A1 Q9NP59 2/20 0.44
MAP2K1 Q02750 1/20 0.43
EGLN1 Q9GZT9 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
PSMD14 O00487 1/20 0.40

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
SCHEMBL27402380 0.85 KDM4E (0.47) KDM4EALOX15HTTALDH1A1SLC40A1
SCHEMBL1228229 0.80 KDM4E (0.50) KDM4EALOX15HTTALDH1A1SLC40A1
SCHEMBL18369670 0.78 PSMD14 (0.51) KDM4EALOX15HTTALDH1A1SLC40A1
SCHEMBL12072279 0.78 KDM4E (0.55) KDM4EHTTALDH1A1SLC40A1MAP2K1
SCHEMBL17596179 0.78 KDM4E (0.55) KDM4EALOX15HTTALDH1A1SLC40A1
SCHEMBL3502575 0.77 KDM4E (0.56) KDM4EALOX15HTTALDH1A1SLC40A1
SCHEMBL20328552 0.76 ATM (0.36) KDM4EHTTALDH1A1L3MBTL1KMT2A
SCHEMBL29046675 0.75 KDM4E (0.55) KDM4EALOX15HTTALDH1A1SLC40A1
SCHEMBL17596177 0.75 NPC1 (0.42) KDM4EALOX15HTTALDH1A1SLC40A1
SCHEMBL21878514 0.75 KDM4E (0.55) KDM4EALOX15HTTALDH1A1SLC40A1

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-106715425-B Herbicidal quinolines 先正达参股股份有限公司 2020-11-06 CN disclosed
EP-3191465-B1 HERBICIDAL QUINOLINES SYNGENTA PARTICIPATIONS AG (CH) 2018-12-19 EP disclosed
US-9980486-B2 Herbicidal quinolines SYNGENTA PARTICIPATIONS AG (CH) 2018-05-29 US disclosed
US-20170251670-A1 HERBICIDAL QUINOLINES SYNGENTA PARTICIPATIONS AG (CH) 2017-09-07 US disclosed
EP-3191465-A1 HERBICIDAL QUINOLINES Syngenta Participations AG (CH) 2017-07-19 EP disclosed
CN-106715425-A Herbicidal quinolines 先正达参股股份有限公司 2017-05-24 CN disclosed
WO-2016038173-A1 HERBICIDAL QUINOLINES SYNGENTA PARTICIPATIONS AG (CH) 2016-03-17 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-20170251670-A1 HERBICIDAL QUINOLINES NQO2, DDT, ATP1B1 KDM4E 1955/4885ALOX15 2507/4885HTT 697/4885

“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.