SCHEMBL1935935

SCHEMBL1935935

Fc1cccc(C(F)(F)F)c1-c1ccncc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.49
LMNA P02545 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KIF11 P52732 1/20 0.44
SCN9A Q15858 3/20 0.41
SCN5A Q14524 2/20 0.41
MAPK14 Q16539 5/20 0.40
CSNK1D P48730 2/20 0.40
CSNK1E P49674 2/20 0.40
KMT2A Q03164 1/20 0.40
PTPN1 P18031 1/20 0.37
TYK2 P29597 1/20 0.37
CYP11B2 P19099 1/20 0.36
MAPT P10636 1/20 0.36
HSD11B1 P28845 1/20 0.36
NOTUM Q6P988 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
SCHEMBL5123247 0.82 TRPA1 (0.49) TRPA1KIF11SCN9AMAPK14PTPN1
SCHEMBL2649168 0.82 LMNA (0.58) LMNANPC1RAB9AMAPK14CSNK1D
SCHEMBL1936068 0.80 TYK2 (0.49) NPC1RAB9AKIF11SCN9ASCN5A
SCHEMBL30568365 0.80 TRPA1 (0.47) TRPA1KIF11SCN9AMAPK14PTPN1
SCHEMBL24196850 0.78 TRPA1 (0.49) TRPA1KIF11SCN9ASCN5AMAPK14
SCHEMBL1934700 0.75 TRPA1 (0.43) TRPA1KIF11SCN9ASCN5AMAPK14
SCHEMBL30270504 0.75 TRPA1 (0.47) TRPA1KIF11SCN9A
SCHEMBL28160302 0.74 KIF11 (0.57) TRPA1KIF11CYP11B2
SCHEMBL1198285 0.74 TRPA1 (0.52) TRPA1KIF11SCN9ASCN5AMAPK14
SCHEMBL1936006 0.74 TRPA1 (0.49) TRPA1KIF11SCN9ASCN5AMAPK14

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 324/4885LMNA 3940/4885NPC1 4526/4885

“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.