SCHEMBL1935634

SCHEMBL1935634

N#Cc1cc(-c2cccc(F)c2C(F)(F)F)ccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.49
ALOX5AP P20292 2/20 0.39
FEN1 P39748 2/20 0.39
MYC P01106 1/20 0.39
SCN9A Q15858 1/20 0.38
NPY5R Q15761 1/20 0.38
BDKRB1 P46663 1/20 0.38
PIK3R2 O00459 2/20 0.38
XDH P47989 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
LRRK2 Q5S007 1/20 0.36
CTSS P25774 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
P2RX7 Q99572 1/20 0.36
GRM2 Q14416 1/20 0.35
TGFBR1 P36897 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
SCHEMBL1933954 0.82 ALOX5AP (0.49) TRPA1ALOX5APFEN1MYCNPY5R
SCHEMBL1934569 0.81 AR (0.43) ALOX5APFEN1MYCSCN9ANPY5R
SCHEMBL1935087 0.78 AR (0.57) TRPA1ALOX5APFEN1MYCSCN9A
SCHEMBL1936006 0.78 TRPA1 (0.49) TRPA1MYCSCN9ANPY5RXDH
SCHEMBL1935098 0.76 MPL (0.43) ALOX5APFEN1MYCNPY5RXDH
SCHEMBL13382702 0.74 SCN9A (0.47) TRPA1SCN9ABDKRB1GABRA1GABRG2
SCHEMBL1936060 0.74 TRPA1 (0.49) TRPA1SCN9AP2RX7
SCHEMBL1934836 0.74 CTSS (0.60) MYCCTSSTGFBR1
SCHEMBL17116812 0.73 MYC (0.54) MYCNPY5RXDHABCG2LRRK2
SCHEMBL1935090 0.73 TRPA1 (0.48) TRPA1ALOX5APFEN1MYCSCN9A

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 324/4885ALOX5AP 579/4885FEN1 3369/4885

“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.