SCHEMBL17596179

SCHEMBL17596179

COC(=O)c1cc(Br)c2ncccc2c1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.55
MAP2K1 Q02750 1/20 0.49
PSMD14 O00487 1/20 0.46
HSP90AA1 P07900 2/20 0.45
NPC1 O15118 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TDP1 Q9NUW8 2/20 0.42
HTT P42858 2/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 2/20 0.41
COMT P21964 1/20 0.41
POLB P06746 1/20 0.40
ATM Q13315 1/20 0.40
ALOX15 P16050 1/20 0.40
SLC40A1 Q9NP59 2/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL12072279 0.89 KDM4E (0.55) KDM4EMAP2K1PSMD14HSP90AA1NPC1
SCHEMBL21878514 0.89 KDM4E (0.55) KDM4EMAP2K1PSMD14HSP90AA1NPC1
SCHEMBL17113034 0.81 KDM4E (0.71) KDM4EMAP2K1PSMD14L3MBTL1MEN1
SCHEMBL23233761 0.81 KDM4E (0.70) KDM4EMAP2K1PSMD14HSP90AA1NPC1
SCHEMBL21902359 0.81 KDM4E (0.59) KDM4EMAP2K1PSMD14HSP90AA1NPC1
SCHEMBL19128191 0.80 KDM4E (0.53) KDM4EMAP2K1PSMD14HSP90AA1L3MBTL1
SCHEMBL23212200 0.80 KDM4E (0.57) KDM4EMAP2K1PSMD14L3MBTL1MEN1
SCHEMBL244414 0.79 KDM4E (0.45) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL15054071 0.78 KDM4E (0.62) KDM4EMAP2K1PSMD14HSP90AA1L3MBTL1
SCHEMBL31056854 0.78 KDM4E (0.62) KDM4EMAP2K1PSMD14HSP90AA1L3MBTL1

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
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
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 1955/4885MAP2K1 4029/4885PSMD14 4556/4885

“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.