SCHEMBL1936046

SCHEMBL1936046

N#Cc1cc(-c2ccc(F)cc2C(F)(F)F)ccn1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.48
NPY5R Q15761 2/20 0.44
GABRA1 P14867 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA3 P34903 1/20 0.40
GRM5 P41594 3/20 0.40
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
GRM2 Q14416 1/20 0.40
MYC P01106 1/20 0.40
AR P10275 2/20 0.38
XDH P47989 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37

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
SCHEMBL1935090 0.89 TRPA1 (0.48) TRPA1NPY5RGABRA1GABRG2GABRB3
SCHEMBL1936365 0.86 ALOX5AP (0.44) NPY5RALOX5APFEN1GRM2MYC
SCHEMBL1934802 0.84 GRM2 (0.43) GRM5GRM2MYCARXDH
SCHEMBL1935087 0.82 AR (0.57) TRPA1ALOX5APFEN1GRM2MYC
SCHEMBL1935323 0.82 AR (0.46) GRM2AR
SCHEMBL1934569 0.79 AR (0.43) NPY5RALOX5APFEN1GRM2MYC
SCHEMBL1934845 0.77 GRM2 (0.42) NPY5RALOX5APFEN1GRM2MYC
SCHEMBL1936074 0.77 MYC (0.48) NPY5RMYCARXDHABCG2
SCHEMBL12439816 0.76 GRM2 (0.43) GRM2MYCARXDHABCG2
SCHEMBL2952766 0.75 MYC (0.59) NPY5RMYCXDHABCG2

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 6 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

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 324/4885NPY5R 1198/4885GABRA1 3792/4885

“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.