SCHEMBL2301019

SCHEMBL2301019

O=C(O)c1nc(Cl)ccc1OC(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.45
ALPL P05186 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
EPHX2 P34913 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
DHODH Q02127 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
GAA P10253 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.34
EGLN1 Q9GZT9 1/20 0.34
PIM1 P11309 1/20 0.34
IGF1R P08069 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL14354395 0.77 KDM4E (0.47) KMOKDM4EALDH1A1KMT2AL3MBTL1
SCHEMBL2302384 0.74 SLC1A5 (0.38) KMOEPHX2
SCHEMBL31361182 0.74 SLC1A5 (0.38) KMOEPHX2
SCHEMBL287491 0.74 KMO (0.41) KMOKDM4EALDH1A1KMT2AMAPT
SCHEMBL2301805 0.73 DHODH (0.41) KMOALDH1A1KMT2ADHODHAKR1C2
SCHEMBL2306249 0.73 KMO (0.49) KMOALPLKDM4EEPHX2RXRA
SCHEMBL25379638 0.72 SCN3A (0.44) KMOALDH1A1KMT2AGAA
Clopyralid SCHEMBL54779 0.72 KMT2A (0.50) KDM4EALDH1A1KMT2AL3MBTL1GAA
Clopyralid SCHEMBL29371357 0.72 KMT2A (0.50) KDM4EALDH1A1KMT2AL3MBTL1GAA
Clopyralid SCHEMBL8535196 0.72 KMT2A (0.50) KDM4EALDH1A1KMT2AL3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109956929-B Heterocyclic derivative, preparation method, pharmaceutical composition and application thereof 上海迪诺医药科技有限公司 2023-09-19 CN disclosed
WO-2023165957-A1 SUBSTITUTED 1,2,4-THIADIAZOLYL PICOLINAMIDES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2023-09-07 WO disclosed
EP-4238972-A1 SUBSTITUTED 1,2,4-THIADIAZOLYL PICOLINAMIDES, SALTS OR N-OXIDES THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer AG (DE) 2023-09-06 EP disclosed
CN-110156656-B Five-membered heteroaromatic ring derivative, preparation method thereof, pharmaceutical composition and application 上海迪诺医药科技有限公司 2023-04-07 CN disclosed
EP-2350008-B1 METHOD FOR THE PREPARATION OF FUNCTIONALIZED TRIHALOMETHOXY SUBSTITUTED PYRIDINES BAYER CROPSCIENCE AG (DE) 2012-09-05 EP disclosed
EP-2350008-A1 METHOD FOR THE PREPARATION OF FUNCTIONALIZED TRIHALOMETHOXY SUBSTITUTED PYRIDINES Bayer CropScience AG (DE) 2011-08-03 EP disclosed
WO-2010040461-A1 METHOD FOR THE PREPARATION OF FUNCTIONALIZED TRIHALOMETHOXY SUBSTITUTED PYRIDINES BAYER CROPSCIENCE AG (DE) 2010-04-15 WO disclosed