SCHEMBL1934816

SCHEMBL1934816

Fc1ccc(C(F)(F)F)c(-c2ccncc2)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.50
KIF11 P52732 1/20 0.44
MAPK14 Q16539 11/20 0.42
GCGR P47871 3/20 0.42
SRC P12931 1/20 0.41
BRAF P15056 1/20 0.41
KDR P35968 1/20 0.41
MAPK13 O15264 2/20 0.40
MAPK12 P53778 2/20 0.40
MAPK11 Q15759 2/20 0.40
S1PR1 P21453 1/20 0.40
S1PR3 Q99500 1/20 0.40
CYP11B2 P19099 2/20 0.40
NTRK1 P04629 1/20 0.39
CYP11B1 P15538 1/20 0.39

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
SCHEMBL1935130 0.85 TRPA1 (0.50) TRPA1KIF11MAPK14GCGRSRC
SCHEMBL1936008 0.81 KIF11 (0.59) KIF11SRCBRAFKDRS1PR1
SCHEMBL12439813 0.80 CYP46A1 (0.46) KIF11MAPK14GCGRS1PR1S1PR3
SCHEMBL30568360 0.80 TRPA1 (0.49) TRPA1KIF11CYP11B2
SCHEMBL21131387 0.80 TRPA1 (0.49) TRPA1KIF11CYP11B2
SCHEMBL1934713 0.76 TRPA1 (0.46) TRPA1KIF11S1PR1CYP11B2
SCHEMBL25184277 0.76 MAPK14 (0.47) MAPK14GCGRMAPK13MAPK12MAPK11
SCHEMBL1935579 0.76 TEK (0.51) MAPK14GCGRCYP11B2CYP11B1
SCHEMBL29914881 0.76 S1PR1 (0.57) KIF11MAPK14GCGRS1PR1S1PR3
SCHEMBL1935090 0.75 TRPA1 (0.48) TRPA1KIF11

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
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 324/4885KIF11 3762/4885MAPK14 1911/4885

“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.