SCHEMBL20740835

SCHEMBL20740835

N=Cc1ccc(C(F)(F)F)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 12/20 0.56
▸ KDM1A O60341 1/20 0.43
▸ CYP11B2 P19099 6/20 0.40
▸ CYP11B1 P15538 4/20 0.40
▸ GPR3 P46089 1/20 0.38

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
SCHEMBL29438427 0.83 KIF11 (0.73) KIF11KDM1ACYP11B2CYP11B1
SCHEMBL48409 0.83 KIF11 (0.73) KIF11KDM1ACYP11B2CYP11B1
SCHEMBL11855670 0.83 KIF11 (0.53) KIF11KDM1ACYP11B2CYP11B1GPR3
SCHEMBL25512421 0.80 PTGS1 (0.42) KIF11
SCHEMBL27642819 0.79 KIF11 (0.54) KIF11KDM1ACYP11B2CYP11B1
SCHEMBL8345423 0.78 NFE2L2 (0.50) KIF11
SCHEMBL20758546 0.78 KIF11 (0.49) KIF11KDM1ACYP11B2CYP11B1
SCHEMBL21402590 0.77 KIF11 (0.56) KIF11KDM1A
SCHEMBL3182714 0.77 KIF11 (0.51) KIF11KDM1A
SCHEMBL13636812 0.75 KIF11 (0.46) KIF11KDM1A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190053492-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2019-02-21 — — US claimed
CN-109071444-A N- (cyanobenzyl) -6- (cyclopropyl-carbonylamino) -4- (phenyl) -pyridine-2-carboxamide derivatives and related compounds as pesticides and plant protection agents 拜耳作物科学股份公司 2018-12-21 — — CN claimed
US-20190053492-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2019-02-21 — — US disclosed
CN-109071444-A N- (cyanobenzyl) -6- (cyclopropyl-carbonylamino) -4- (phenyl) -pyridine-2-carboxamide derivatives and related compounds as pesticides and plant protection agents 拜耳作物科学股份公司 2018-12-21 — — CN 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-20190053492-A1 SUBSTITUTED PYRIDINE COMPOUNDS AS PESTICIDES CHRM1, CHRM2, ACHE KIF11 3107/4885KDM1A 553/4885CYP11B2 1062/4885

“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.

Send feedback