SCHEMBL10140229

SCHEMBL10140229

CNC(=O)c1cc(C#N)cc(C)c1NC(=O)c1cc(Br)nn1-c1ncccc1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.37
PKM P14618 1/20 0.36
EGLN1 Q9GZT9 2/20 0.34
SORT1 Q99523 1/20 0.34
KMT2A Q03164 3/20 0.33
JAK1 P23458 2/20 0.33
TYK2 P29597 2/20 0.33
JAK2 O60674 1/20 0.33
JAK3 P52333 1/20 0.33
SLC2A1 P11166 1/20 0.32
SLC2A2 P11168 1/20 0.32
SLC2A3 P11169 1/20 0.32
SLC2A4 P14672 1/20 0.32
STAT3 P40763 1/20 0.32
KCNH2 Q12809 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
XIAP P98170 1/20 0.32
BIRC2 Q13490 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31

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
Cyantraniliprole SCHEMBL29354965 0.93 DHODH (0.42) DHODHPKMEGLN1KMT2AJAK1
Cyantraniliprole SCHEMBL166640 0.93 DHODH (0.42) DHODHPKMEGLN1KMT2AJAK1
SCHEMBL11893256 0.92 KMT2A (0.35) DHODHPKMEGLN1KMT2AJAK1
SCHEMBL14227755 0.92 DHODH (0.40) DHODHPKMEGLN1SORT1KMT2A
SCHEMBL16606345 0.92 SORT1 (0.40) DHODHPKMSORT1KMT2AJAK1
SCHEMBL13442912 0.91 DHODH (0.37) DHODHPKMSORT1KMT2AJAK1
SCHEMBL10140235 0.91 PDE4A (0.36) DHODHPKMEGLN1SORT1KMT2A
SCHEMBL13630504 0.91 EGLN1 (0.37) DHODHPKMEGLN1SORT1KMT2A
SCHEMBL10140237 0.89 KMT2A (0.36) DHODHPKMEGLN1KMT2AJAK1
SCHEMBL13913221 0.89 PKM (0.36) PKMEGLN1KMT2AJAK1TYK2

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9949482-B2 Fungicidal compositions SYNGENTA CROP PROTECTION, LLC (US) 2018-04-24 US disclosed
US-9801378-B2 Method of controlling pest SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-31 US disclosed
US-20170202220-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, LLC (US) 2017-07-20 US disclosed
US-9642365-B2 Fungicidal compositions SYNGENTA CROP PROTECTION, LLC (US) 2017-05-09 US disclosed
US-20170071205-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, LLC (US) 2017-03-16 US disclosed
US-20160302414-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2016-10-20 US disclosed
US-20160192655-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, LLC (US) 2016-07-07 US disclosed
US-9314022-B2 Fungicidal compositions SYNGENTA CROP PROTECTION, LLC (US) 2016-04-19 US disclosed
US-9282743-B2 Chemical compounds SYNGENTA PARTICIPATIONS AG (CH) 2016-03-15 US disclosed
US-20150366200-A1 FUNGICIDAL COMPOSITIONS COMPRISING A CARBOXAMIDE SYNGENTA PARTICIPATIONS AG (CH) 2015-12-24 US disclosed
US-20110184183-A1 METHOD FOR PREPARING A NON-HYDRATABLE CRYSTAL FORM E.I. DUPONT DE NEMOURS AND COMPANY (US) 2011-07-28 US disclosed
US-20110142802-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, INC. (US) 2011-06-16 US disclosed
US-20110015153-A1 FLY CONTROL METHOD E.I. DU PONT DE NEMOURS AND COMPANY (US) 2011-01-20 US disclosed
US-20100216640-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, INC. (US) 2010-08-26 US disclosed
US-20100099717-A1 SUSPENSION CONCENTRATES FOR IMPROVING THE ROOT ABSORPTION OF AGROCHEMICAL ACTIVE INGREDIENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-04-22 US disclosed
US-20090149506-A1 INSECTICIDAL COMPOSITIONS WITH IMPROVED EFFECT BAYER CROPSCIENCE AG (DE) 2009-06-11 US disclosed
US-20080076664-A1 Fungicidal Compositions SYNGENTA CROP PROTECTION, INC. 2008-03-27 US disclosed
US-20080070785-A1 For controlling phytopathogenic diseases; synergistic SYNGENTA CROP PROTECTION, INC. (US) 2008-03-20 US disclosed
US-20070265267-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION, INC. (US) 2007-11-15 US disclosed
US-20070244121-A1 Synergistic Fungicidal Compositions SYNGENTA CROP PROTECTION, INC. (US) 2007-10-18 US 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 (15 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-20090149506-A1 INSECTICIDAL COMPOSITIONS WITH IMPROVED EFFECT PTEN, PPA1, NAAA DHODH 1604/4885PKM 2171/4885EGLN1 1878/4885
US-20150366200-A1 FUNGICIDAL COMPOSITIONS COMPRISING A CARBOXAMIDE CBR3, CBR1, C9 DHODH 1203/4885PKM 1815/4885EGLN1 377/4885
US-20110184183-A1 METHOD FOR PREPARING A NON-HYDRATABLE CRYSTAL FORM NONO, NAF1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 DHODH 2474/4885PKM 2526/4885EGLN1 1219/4885
US-20110142802-A1 FUNGICIDAL COMPOSITIONS CYP4X1, CYP1B1, CYP4B1 DHODH 834/4885PKM 2867/4885EGLN1 1042/4885
US-20160192655-A1 FUNGICIDAL COMPOSITIONS BROX, RER1, BLVRB DHODH 677/4885PKM 3466/4885EGLN1 118/4885
US-20100216640-A1 FUNGICIDAL COMPOSITIONS BROX, RER1, BLVRB DHODH 866/4885PKM 3454/4885EGLN1 118/4885
US-20100099717-A1 SUSPENSION CONCENTRATES FOR IMPROVING THE ROOT ABSORPTION OF AGROCHEMICAL ACTIVE INGREDIENTS CROCC, SLC19A1, ABCB11 DHODH 1828/4885PKM 4045/4885EGLN1 988/4885
US-20160302414-A1 INSECTICIDAL COMPOUNDS ACHE, AADAC, CASP3 DHODH 1693/4885PKM 2201/4885EGLN1 869/4885
US-20110015153-A1 FLY CONTROL METHOD C5, CHRM2, C1S DHODH 2401/4885PKM 2896/4885EGLN1 1625/4885
US-20170202220-A1 FUNGICIDAL COMPOSITIONS BROX, RER1, BLVRB DHODH 677/4885PKM 3466/4885EGLN1 118/4885
US-20070265267-A1 FUNGICIDAL COMPOSITIONS CRY1, ERG28, DDT DHODH 2433/4885PKM 187/4885EGLN1 1174/4885
US-20070244121-A1 Synergistic Fungicidal Compositions DDT, CRY1, HCN1 DHODH 1980/4885PKM 174/4885EGLN1 2039/4885
US-20080070785-A1 For controlling phytopathogenic diseases; synergistic BROX, EPM2A, MANBA DHODH 2383/4885PKM 522/4885EGLN1 1009/4885
US-20170071205-A1 FUNGICIDAL COMPOSITIONS PIK3C3, CYP51A1, CYP1B1 DHODH 874/4885PKM 1154/4885EGLN1 457/4885
US-20080076664-A1 Fungicidal Compositions AKR7A2, CYP51A1, TUBA3C DHODH 717/4885PKM 645/4885EGLN1 1680/4885

“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.