SCHEMBL1936008

SCHEMBL1936008

FC(F)(F)c1ccc(C(F)(F)F)c(-c2ccncc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.59
EPHX2 P34913 1/20 0.47
CYP19A1 P11511 1/20 0.46
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 1/20 0.46
CES2 O00748 1/20 0.42
SRC P12931 1/20 0.41
BRAF P15056 1/20 0.41
KDR P35968 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ABL1 P00519 1/20 0.41
BCR P11274 1/20 0.41
S1PR1 P21453 3/20 0.41
S1PR3 Q99500 3/20 0.41
SLC22A12 Q96S37 1/20 0.40
SCN9A Q15858 3/20 0.40
CYP2C9 P11712 2/20 0.40
SCN5A Q14524 1/20 0.40
POLQ O75417 1/20 0.40

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
SCHEMBL28020463 0.85 KIF11 (0.59) KIF11EPHX2CYP19A1CYP11B1CYP11B2
SCHEMBL1934816 0.81 TRPA1 (0.50) KIF11CYP11B1CYP11B2SRCBRAF
SCHEMBL2300881 0.81 KIF11 (0.54) KIF11CES2NPC1RAB9ASCN9A
SCHEMBL15009854 0.80 KIF11 (0.57) KIF11EPHX2CYP19A1CYP11B1CYP11B2
SCHEMBL12439813 0.80 CYP46A1 (0.46) KIF11CYP19A1CYP11B1CYP11B2NPC1
SCHEMBL25795114 0.80 KIF11 (0.57) KIF11EPHX2CYP19A1CYP11B1CYP11B2
SCHEMBL16311807 0.80 KIF11 (0.57) KIF11EPHX2CYP19A1CYP11B1CYP11B2
SCHEMBL5990646 0.80 KIF11 (0.57) KIF11EPHX2CYP19A1CYP11B1CYP11B2
SCHEMBL25011713 0.78 NPBWR1 (0.45) KIF11CYP11B1CYP11B2CES2NPC1
SCHEMBL1827783 0.78 KIF11 (0.59) KIF11CES2SCN9ACYP2C9SCN5A

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 5 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
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 KIF11 3762/4885EPHX2 1218/4885CYP19A1 1651/4885

“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.