SCHEMBL2561571

SCHEMBL2561571

O=C1C2CCC1c1c(Cl)cccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNG8 Q8WXS5 2/20 0.40
CACNB4 O00305 1/20 0.40
CACNA1A O00555 1/20 0.40
CACNA1G O43497 1/20 0.40
CACNG3 O60359 1/20 0.40
CACNA1F O60840 1/20 0.40
CACNA1H O95180 1/20 0.40
CACNB3 P54284 1/20 0.40
CACNA2D1 P54289 1/20 0.40
CACNG7 P62955 1/20 0.40
CACNA1B Q00975 1/20 0.40
CACNA1D Q01668 1/20 0.40
CACNB1 Q02641 1/20 0.40
CACNG1 Q06432 1/20 0.40
CACNB2 Q08289 1/20 0.40
CACNA1S Q13698 1/20 0.40
CACNA1C Q13936 1/20 0.40
CACNA1E Q15878 1/20 0.40
CACNA2D4 Q7Z3S7 1/20 0.40
CACNA2D3 Q8IZS8 1/20 0.40

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
SCHEMBL6326457 0.84 SMN1; SMN2 (0.41) CACNG8CACNB4CACNA1ACACNA1GCACNG3
SCHEMBL28284899 0.80 SLC6A2 (0.41) SLC6A4SLC6A2SLC6A3
SCHEMBL12224219 0.77 DDB1 (0.40) HTR2AHTR2CHTR2BADRA2AADRA2B
SCHEMBL12533480 0.77 ADRA2A (0.32) RECQLSLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL13273127 0.77 SMN1; SMN2 (0.36) CACNG8CACNB4CACNA1ACACNA1GCACNG3
SCHEMBL2557929 0.74 SMN1; SMN2 (0.34) CACNG8CACNB4CACNA1ACACNA1GCACNG3
SCHEMBL2563364 0.73 SLC6A4 (0.35) SMN1; SMN2SLC6A4SLC6A2SLC6A3
SCHEMBL14682740 0.72 SLC6A4 (0.34) SLC6A4SLC6A2SLC6A3
SCHEMBL4572402 0.72 TDP1 (0.41) TP53RECQLSMN1; SMN2
SCHEMBL10040765 0.69

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9169233-B2 Methods for the preparation of aryl amides SYNGENTA LIMITED (GB) 2015-10-27 US disclosed
US-9169233-B2 Methods for the preparation of aryl amides SYNGENTA LIMITED (GB) 2015-10-27 US disclosed
EP-2560959-B1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-08-20 EP disclosed
EP-2560959-B1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-08-20 EP disclosed
US-20140107348-A1 METHODS FOR THE PREPARATION OF ARYL AMIDES SYNGENTA LIMITED (GB) 2014-04-17 US disclosed
US-20140107348-A1 METHODS FOR THE PREPARATION OF ARYL AMIDES SYNGENTA LIMITED (GB) 2014-04-17 US disclosed
EP-2560960-B1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2014-02-26 EP disclosed
US-8637678-B2 Methods for the preparation of aryl amides SYNGENTA LIMITED (GB) 2014-01-28 US disclosed
US-8524915-B2 Process for the preparation of pyrazole carboxylic acid amides SYNGENTA CROP PROTECTION LLC (US) 2013-09-03 US disclosed
US-8524915-B2 Process for the preparation of pyrazole carboxylic acid amides SYNGENTA CROP PROTECTION LLC (US) 2013-09-03 US disclosed
US-20130041160-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA CROP PROTECTION LLC (US) 2013-02-14 US disclosed
US-20130035496-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA CROP PROTECTION LLC (US) 2013-02-07 US disclosed
US-20130035496-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA CROP PROTECTION LLC (US) 2013-02-07 US disclosed
US-20130035496-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA CROP PROTECTION LLC (US) 2013-02-07 US disclosed
WO-2011131545-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2011-10-27 WO disclosed
WO-2011131544-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2011-10-27 WO disclosed
US-20110263869-A1 METHODS FOR THE PREPARATION OF ARYL AMIDES SYNGENTA CROP PROTECTION, LLC (US) 2011-10-27 US disclosed
US-20110263869-A1 METHODS FOR THE PREPARATION OF ARYL AMIDES SYNGENTA CROP PROTECTION, LLC (US) 2011-10-27 US disclosed
US-20110257410-A1 METHODS FOR THE PREPARATION OF FUNGICIDES SYNGENTA CROP PROTECTION, LLC (US) 2011-10-20 US disclosed
US-20110257410-A1 METHODS FOR THE PREPARATION OF FUNGICIDES SYNGENTA CROP PROTECTION, LLC (US) 2011-10-20 US 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-20110257410-A1 METHODS FOR THE PREPARATION OF FUNGICIDES CBR3, CYP4F3, CYP21A2 CACNG8 2337/4885CACNB4 892/4885CACNA1A 1916/4885
US-20140107348-A1 METHODS FOR THE PREPARATION OF ARYL AMIDES SOD1, CBR3, AOC3 CACNG8 4767/4885CACNB4 4500/4885CACNA1A 1175/4885
US-20110263869-A1 METHODS FOR THE PREPARATION OF ARYL AMIDES SOD1, AOC3, CBR3 CACNG8 4776/4885CACNB4 4436/4885CACNA1A 1478/4885
US-20130035496-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES F5, F12, F9 CACNG8 3786/4885CACNB4 4435/4885CACNA1A 2095/4885
US-20130041160-A1 PROCESS FOR THE PREPARATION OF PYRAZOLE CARBOXYLIC ACID AMIDES CBR3, F12, CBR1 CACNG8 3109/4885CACNB4 1904/4885CACNA1A 1860/4885

“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.