SCHEMBL1934845

SCHEMBL1934845

N#Cc1cc(-c2cc(C(F)(F)F)ccc2C(F)(F)F)ccn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.42
XDH P47989 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
CTSS P25774 1/20 0.40
MYC P01106 1/20 0.40
CYP2C9 P11712 2/20 0.39
SCN9A Q15858 2/20 0.39
SCN5A Q14524 1/20 0.39
AR P10275 2/20 0.38
DYRK1A Q13627 1/20 0.38
DGAT1 O75907 1/20 0.38
NPY5R Q15761 1/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
KIF11 P52732 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36

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
SCHEMBL1936365 0.89 ALOX5AP (0.44) GRM2XDHABCG2CTSSMYC
SCHEMBL1935098 0.86 MPL (0.43) GRM2XDHABCG2CTSSMYC
SCHEMBL1935090 0.86 TRPA1 (0.48) GRM2XDHABCG2MYCSCN9A
SCHEMBL12439816 0.84 GRM2 (0.43) GRM2XDHABCG2MYCAR
SCHEMBL1934968 0.84 CTSS (0.44) GRM2XDHABCG2CTSSMYC
SCHEMBL17407898 0.84 DYRK1A (0.42) GRM2XDHABCG2CTSSMYC
SCHEMBL1935087 0.82 AR (0.57) GRM2MYCSCN9AARALOX5AP
SCHEMBL1933615 0.82 PGR (0.46) GRM2XDHABCG2ARCYP3A4
SCHEMBL28042892 0.80 MYC (0.55) XDHABCG2CTSSMYCDGAT1
SCHEMBL29775960 0.78 NOS3 (0.52) XDHABCG2CTSSMYCDGAT1

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
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
WO-2010035899-A1 PYRIDINE COMPOUND AND USE THEREOF FOR PEST CONTROL 住友化学株式会社 (JP) 2010-04-01 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 (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 GRM2 2305/4885XDH 415/4885ABCG2 4299/4885

“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.