SCHEMBL14919971

SCHEMBL14919971

NCC1(c2ncc(Br)cc2Cl)CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.39
SLC6A3 Q01959 16/20 0.36
SLC6A4 P31645 15/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
SLC6A2 P23975 3/20 0.35
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
AKT1 P31749 1/20 0.31

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
SCHEMBL14935005 0.83 SLC6A3 (0.38) SLC6A3SLC6A4SLC6A2MAOAMAOB
SCHEMBL16197589 0.77 SLC6A4 (0.34) SLC6A3SLC6A4SLC6A2
SCHEMBL14920148 0.76 ALDH1A1 (0.45) PLAUSLC6A3SLC6A4HTTKMT2A
SCHEMBL27020188 0.74 PLAU (0.39) PLAUHTTKMT2A
SCHEMBL23580162 0.71 PLAU (0.40) PLAUHTTKMT2A
SCHEMBL14920534 0.71 PLAU (0.44) PLAUHTTKMT2A
SCHEMBL14920377 0.70 SLC6A4 (0.34) SLC6A3SLC6A4
SCHEMBL16000810 0.70 PLAU (0.39) PLAUHTTKMT2A
SCHEMBL16000809 0.70 PLAU (0.36) PLAUHTTKMT2A
SCHEMBL14919923 0.70 PLAU (0.36) PLAUHTTKMT2A

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 36 patents — showing the first 20. 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-10029986-B2 Alkynyl pyridine-substituted amide compound and pesticide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-07-24 US disclosed
US-20170008847-A1 ALKYNYL PYRIDINE-SUBSTITUTED AMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2017-01-12 US disclosed
EP-3109234-A1 ALKYNYLPYRIDINE-SUBSTITUTED AMIDE COMPOUND AND NOXIOUS ORGANISM CONTROL AGENT Nissan Chemical Industries, Ltd. (JP) 2016-12-28 EP disclosed
US-20160309717-A1 Compounds with Nematicidal Activity BAYER CROPSCIENCE AG (DE) 2016-10-27 US disclosed
US-20160309717-A1 Compounds with Nematicidal Activity BAYER CROPSCIENCE AG (DE) 2016-10-27 US disclosed
US-20160309717-A1 Compounds with Nematicidal Activity BAYER CROPSCIENCE AG (DE) 2016-10-27 US disclosed
EP-3083585-A1 COMPOUNDS WITH NEMATICIDAL ACTIVITY Bayer CropScience Aktiengesellschaft (DE) 2016-10-26 EP disclosed
EP-2773631-B1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2015-09-09 EP disclosed
EP-2773631-B1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2015-09-09 EP disclosed
US-20140296066-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
US-20140296067-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-10-02 US disclosed
US-20140296066-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-10-02 US disclosed
US-20140296066-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
EP-2773631-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-2013064519-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 (5 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-20160309717-A1 Compounds with Nematicidal Activity ACHE, NAAA, TUBA3C PLAU 3522/4885SLC6A3 4434/4885SLC6A4 4212/4885
US-20140296067-A1 PESTICIDAL COMPOUNDS C5, CBR3, C3AR1 PLAU 4123/4885SLC6A3 2297/4885SLC6A4 2108/4885
US-10029986-B2 Alkynyl pyridine-substituted amide compound and pesticide CHRM1, CHRM2, CHRM3 PLAU 4881/4885SLC6A3 1784/4885SLC6A4 3414/4885
US-20140296066-A1 PESTICIDAL COMPOUNDS C5, CYC1, ACHE PLAU 4175/4885SLC6A3 3711/4885SLC6A4 3642/4885
US-20170008847-A1 ALKYNYL PYRIDINE-SUBSTITUTED AMIDE COMPOUND AND PESTICIDE CHRM1, CHRM2, CHRM3 PLAU 4881/4885SLC6A3 1784/4885SLC6A4 3414/4885

“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.