SCHEMBL17596158

SCHEMBL17596158

CCOC(=O)c1cc2cccnc2c(-c2ccccc2)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
MAPT P10636 5/20 0.47
KDM4E B2RXH2 5/20 0.47
LMNA P02545 4/20 0.47
HPGD P15428 3/20 0.47
NPSR1 Q6W5P4 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
GAA P10253 2/20 0.47
MAPK1 P28482 2/20 0.46
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.45
POLB P06746 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
TP53 P04637 1/20 0.45
CCR6 P51684 1/20 0.44
HTT P42858 2/20 0.44

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
SCHEMBL17596128 0.88 ALDH1A1 (0.58) ALDH1A1KDM4EHPGDNPSR1RAB9A
SCHEMBL17596170 0.87 ALDH1A1 (0.47) ALDH1A1KDM4ELMNAHPGDNPSR1
SCHEMBL17596186 0.83 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2MAPTKDM4ELMNA
SCHEMBL13255422 0.80 CCR6 (0.47) ALDH1A1SMN1; SMN2MAPTKDM4ELMNA
SCHEMBL5297257 0.76 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2MAPTKDM4ELMNA
SCHEMBL11908675 0.75 CCR1 (0.53) ALDH1A1KDM4EHPGDNPC1RAB9A
SCHEMBL17595555 0.75 KMT2A (0.39) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL17596451 0.75 MEN1 (0.50) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL17595923 0.74 TDP1 (0.47) ALDH1A1KDM4EHPGDNPSR1L3MBTL1
SCHEMBL16533516 0.73 MEN1 (0.46) ALDH1A1SMN1; SMN2MAPTKDM4ELMNA

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 ALDH1A1 33/4885SMN1; SMN2 4299/4885MAPT 3589/4885

“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.