SCHEMBL1936006

SCHEMBL1936006

N#Cc1cc(-c2c(F)cccc2C(F)(F)F)ccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.49
AR P10275 3/20 0.39
MYC P01106 1/20 0.39
SCN9A Q15858 2/20 0.38
NPY5R Q15761 1/20 0.38
CTSS P25774 2/20 0.37
XDH P47989 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
PGR P06401 1/20 0.36
KIF11 P52732 1/20 0.36
BACE1 P56817 1/20 0.36
KCNH2 Q12809 1/20 0.36
MAPK14 Q16539 1/20 0.35
SCN5A Q14524 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GRM2 Q14416 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
SCHEMBL1934569 0.81 AR (0.43) ARMYCSCN9ANPY5RCTSS
SCHEMBL1935087 0.78 AR (0.57) TRPA1ARMYCSCN9APGR
SCHEMBL1936074 0.78 MYC (0.48) ARMYCNPY5RCTSSXDH
SCHEMBL1935634 0.78 TRPA1 (0.49) TRPA1MYCSCN9ANPY5RCTSS
SCHEMBL28160268 0.77 TRPA1 (0.47) TRPA1ARSCN9AKIF11GABRG2
SCHEMBL1935935 0.74 TRPA1 (0.49) TRPA1SCN9AKIF11MAPK14SCN5A
SCHEMBL1934836 0.74 CTSS (0.60) MYCCTSSKCNH2
SCHEMBL1935090 0.73 TRPA1 (0.48) TRPA1ARMYCSCN9ANPY5R
SCHEMBL1936046 0.73 TRPA1 (0.48) TRPA1ARMYCNPY5RXDH
SCHEMBL1933954 0.73 ALOX5AP (0.49) TRPA1MYCNPY5RXDHABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2332936-B1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL CO (JP) 2013-09-04 EP disclosed
EP-2332936-B1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL CO (JP) 2013-09-04 EP disclosed
US-20110178132-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-07-21 US disclosed
US-20110178132-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-07-21 US disclosed
US-20110178132-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-07-21 US disclosed
EP-2332936-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2011-06-15 EP disclosed
EP-2332936-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2011-06-15 EP 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-20110178132-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL C5, PRDX1, PRDX4 TRPA1 324/4885AR 4124/4885MYC 3619/4885

“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.