SCHEMBL1936060

SCHEMBL1936060

Fc1cccc(-c2ccncc2)c1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.49
KIF11 P52732 1/20 0.44
P2RX7 Q99572 1/20 0.42
CCNC P24863 1/20 0.42
CDK8 P49336 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
PKM P14618 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 2/20 0.40
EPHX2 P34913 1/20 0.40
SCN9A Q15858 1/20 0.40
PIK3CD O00329 1/20 0.39
MAPK14 Q16539 4/20 0.36
CSNK1D P48730 2/20 0.36
CSNK1E P49674 2/20 0.36
MAPT P10636 1/20 0.36
PDK2 Q15119 1/20 0.36
NOTUM Q6P988 1/20 0.35
SRC P12931 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
SCHEMBL21357712 0.82 TRPA1 (0.49) TRPA1KIF11P2RX7NPC1RAB9A
SCHEMBL3637569 0.76 NPC1 (0.46) NPC1RAB9APKMKMT2ALMNA
SCHEMBL2649506 0.76 NPC1 (0.58) NPC1RAB9APKMKMT2ALMNA
SCHEMBL30418017 0.76 NPC1 (0.58) NPC1RAB9APKMKMT2ALMNA
SCHEMBL28920777 0.75 TRPA1 (0.47) TRPA1KIF11P2RX7SCN9APDK2
SCHEMBL1934699 0.75 TRPA1 (0.43) TRPA1P2RX7SCN9APDK2
SCHEMBL1935634 0.74 TRPA1 (0.49) TRPA1P2RX7SCN9A
SCHEMBL21629920 0.74 CCNC (0.56) CCNCCDK8SCN9ACSNK1DPDK2
SCHEMBL1423922 0.73 NPC1 (0.46) NPC1RAB9APKMKMT2ALMNA
SCHEMBL13382702 0.73 SCN9A (0.47) TRPA1P2RX7SCN9A

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 8 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
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 TRPA1 324/4885KIF11 3762/4885P2RX7 323/4885

“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.