SCHEMBL14920446

SCHEMBL14920446

CON(CC1(c2ncc(C(F)(F)F)cc2Cl)CC1)C(=O)c1c(F)cccc1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
MAPT P10636 3/20 0.38
MAPK1 P28482 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 2/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
LMNA P02545 3/20 0.37
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
RECQL P46063 1/20 0.36
P2RX7 Q99572 1/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TLR8 Q9NR97 1/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 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
SCHEMBL14920536 0.70 P2RX7 (0.55) ALDH1A1SMN1; SMN2NPSR1MAPTTLR7
SCHEMBL14920987 0.69 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2NPSR1MAPTMAPK1
SCHEMBL16828384 0.68 KMT2A (0.39) ALDH1A1SMN1; SMN2MAPTMAPK1MEN1
SCHEMBL14920571 0.68 MAPK1 (0.53) ALDH1A1SMN1; SMN2NPSR1MAPTMAPK1
SCHEMBL4428168 0.67 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2NPSR1MAPTMEN1
SCHEMBL14920319 0.67 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2NPSR1MAPTMEN1
SCHEMBL14920148 0.67 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2NPSR1MAPTMEN1
SCHEMBL16828379 0.67 MAPK1 (0.45) ALDH1A1SMN1; SMN2NPSR1MAPTMAPK1
SCHEMBL18413429 0.66 MAPT (0.47) ALDH1A1SMN1; SMN2NPSR1MAPTMEN1
SCHEMBL14935025 0.65 P2RX7 (0.43) ALDH1A1MEN1KMT2AHCRTR1P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2773617-B1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-08-22 EP disclosed
US-20150223456-A1 PESTICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2015-08-13 US disclosed
US-20150223456-A1 PESTICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2015-08-13 US disclosed
US-20150223456-A1 PESTICIDAL COMPOUNDS SYNGENTA LIMITED (GB) 2015-08-13 US disclosed
US-9040708-B2 Pesticidal compounds SYNGENTA LIMITED (GB) 2015-05-26 US disclosed
US-9040708-B2 Pesticidal compounds SYNGENTA LIMITED (GB) 2015-05-26 US disclosed
US-9040708-B2 Pesticidal compounds SYNGENTA LIMITED (GB) 2015-05-26 US disclosed
US-20140296067-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-10-02 US disclosed
US-20140296067-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-10-02 US disclosed
US-20140296067-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-10-02 US disclosed
EP-2773617-A1 PESTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2014-09-10 EP disclosed
WO-2013064521-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-05-10 WO disclosed
WO-2013064521-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-05-10 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 (2 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-20150223456-A1 PESTICIDAL COMPOUNDS C5, CBR3, C3AR1 ALDH1A1 1233/4885SMN1; SMN2 4296/4885NPSR1 357/4885
US-20140296067-A1 PESTICIDAL COMPOUNDS C5, CBR3, C3AR1 ALDH1A1 1233/4885SMN1; SMN2 4296/4885NPSR1 357/4885

“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.