SCHEMBL783445

SCHEMBL783445

O=C(CN1C(=O)c2ccccc2C1=O)c1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GLA P06280 2/20 0.55
HPGD P15428 2/20 0.55
ALDH1A1 P00352 6/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
MAPT P10636 3/20 0.43
GAA P10253 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 3/20 0.43
KDM4E B2RXH2 2/20 0.42
HTT P42858 1/20 0.41

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
SCHEMBL16711760 0.86 HPGD (0.50) GLAHPGDALDH1A1MEN1KMT2A
SCHEMBL16711763 0.86 HPGD (0.50) GLAHPGDALDH1A1MEN1KMT2A
SCHEMBL16711777 0.84 KMT2A (0.56) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL18335131 0.81 GSK3B (0.53) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL16711995 0.81 HPGD (0.45) GLAHPGDALDH1A1MEN1KMT2A
SCHEMBL16711996 0.81 HPGD (0.45) GLAHPGDALDH1A1MEN1KMT2A
SCHEMBL16711729 0.79 NPC1 (0.56) ALDH1A1KMT2ARAB9ASMN1; SMN2MAPT
SCHEMBL6160194 0.78 KMT2A (0.53) GLAHPGDALDH1A1MEN1KMT2A
SCHEMBL16711935 0.77 CYP2C9 (0.42) GLAHPGDALDH1A1MEN1KMT2A
SCHEMBL16711934 0.77 CYP2C9 (0.42) GLAHPGDALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2873658-B1 OXIME-SUBSTITUTED AMIDE COMPOUND AND PEST CONTROL AGENT NISSAN CHEMICAL IND LTD (JP) 2018-09-05 EP disclosed
US-9920046-B2 Oxime-substituted amide compound and pest control agent NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-03-20 US disclosed
US-20160318919-A1 OXIME-SUBSTITUTED AMIDE COMPOUND AND PEST CONTROL AGENT NISSAN CHEMICAL INDUSTRIES, LTD (JP) 2016-11-03 US disclosed
US-9434684-B2 Oxime-substituted amide compound and pest control agent NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-09-06 US disclosed
US-20150210630-A1 OXIME-SUBSTITUTED AMIDE COMPOUND AND PEST CONTROL AGENT NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-07-30 US disclosed
EP-1694648-B1 2-PYRIDINYLETHYLBENZAMIDE DERIVATIVES BAYER SAS (FR) 2015-07-29 EP disclosed
EP-2873658-A1 OXIME-SUBSTITUTED AMIDE COMPOUND AND PEST CONTROL AGENT Nissan Chemical Industries, Ltd. (JP) 2015-05-20 EP disclosed
EP-1694649-B1 2-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER SAS (FR) 2014-01-22 EP disclosed
US-8318777-B2 2-pyridinylethylcarboxamide derivatives and their use as fungicides BAYER SAS (FR) 2012-11-27 US disclosed
US-20120071517-A1 2-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER SAS (FR) 2012-03-22 US disclosed
US-8071627-B2 2-pyridinylethylcarboxamide derivatives and their use as fungicides BAYER SAS (FR) 2011-12-06 US disclosed
US-7560567-B2 2-pyridinylethylbenzamide derivatives BAYER CROPSCIENCE S.A. (FR) 2009-07-14 US disclosed
US-20090088456-A1 2-Pyridinylethylcarboxamide derivatives and their use as Fugicides BAYER CROPSCIENCE S.A. 2009-04-02 US disclosed
US-20070117845-A1 2-Pyridinylethylcarboxamide derivatives and their use as fungicides BAYER CROPSCIENCE S.A. (FR) 2007-05-24 US disclosed
US-20070099965-A1 2-Pyridinylethylbenzamide derivatives BAYER SAS (FR) 2007-05-03 US disclosed
EP-1694649-A1 2-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES Bayer CropScience S.A. (FR) 2006-08-30 EP disclosed
WO-2005058833-A1 2-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2005-06-30 WO disclosed
EP-1548007-A1 2-Pyridinylethylcarboxamide derivatives and their use as fungicides Bayer CropScience S.A. (FR) 2005-06-29 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 (6 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-20090088456-A1 2-Pyridinylethylcarboxamide derivatives and their use as Fugicides PFAS, CYP4F2, FPGS GLA 529/4885HPGD 992/4885ALDH1A1 1119/4885
US-20070117845-A1 2-Pyridinylethylcarboxamide derivatives and their use as fungicides CYP1A2, PNPO, PFAS GLA 251/4885HPGD 1954/4885ALDH1A1 1103/4885
US-20160318919-A1 OXIME-SUBSTITUTED AMIDE COMPOUND AND PEST CONTROL AGENT CHRM1, CHRM2, CHRM4 GLA 2968/4885HPGD 3835/4885ALDH1A1 3899/4885
US-20120071517-A1 2-PYRIDINYLETHYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES CYP1A2, CYP51A1, CYP3A5 GLA 785/4885HPGD 2893/4885ALDH1A1 831/4885
US-20070099965-A1 2-Pyridinylethylbenzamide derivatives CYP1A2, CYP4B1, CYP4F2 GLA 196/4885HPGD 1397/4885ALDH1A1 772/4885
US-20150210630-A1 OXIME-SUBSTITUTED AMIDE COMPOUND AND PEST CONTROL AGENT CHRM1, CHRM2, CHRM4 GLA 2968/4885HPGD 3835/4885ALDH1A1 3899/4885

“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.