SCHEMBL17596190

SCHEMBL17596190

Cn1nnnc1NC(=O)c1cc2cccnc2c(-c2ccccc2)c1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
S1PR1 P21453 2/20 0.40
S1PR3 Q99500 2/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
EGLN1 Q9GZT9 2/20 0.38
LMNA P02545 2/20 0.38
GLA P06280 1/20 0.38
NTRK1 P04629 4/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MALT1 Q9UDY8 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
AHR P35869 1/20 0.35

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
SCHEMBL17595560 0.88 POLB (0.44) POLBS1PR1S1PR3LMNAGLA
SCHEMBL17596503 0.87 POLB (0.54) POLBL3MBTL1EGLN1LMNANPC1
SCHEMBL18309314 0.86 POLB (0.44) POLBS1PR1S1PR3LMNAGLA
SCHEMBL20328550 0.86 POLB (0.44) POLBS1PR1S1PR3LMNAGLA
SCHEMBL17596180 0.86 POLB (0.47) POLBS1PR1S1PR3EGLN1LMNA
SCHEMBL17595553 0.85 POLB (0.47) POLBEGLN1LMNANPC1MAPT
SCHEMBL17596563 0.85 POLB (0.47) POLBS1PR1S1PR3EGLN1LMNA
SCHEMBL17596175 0.77 POLB (0.42) POLBCYP2C9
SCHEMBL18309316 0.77 POLB (0.44) POLBS1PR1S1PR3LMNAGLA
SCHEMBL17596120 0.77 L3MBTL1 (0.50) L3MBTL1EGLN1LMNANPC1RAB9A

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 POLB 2353/4885S1PR1 1531/4885S1PR3 1264/4885

“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.