SCHEMBL28166126

SCHEMBL28166126

CCOC(=O)c1cc(CC(C)=O)cnc1C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.46
ALDH1A1 P00352 5/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 3/20 0.42
HPGD P15428 3/20 0.42
HSD17B10 Q99714 1/20 0.42
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 1/20 0.41
HSP90AA1 P07900 1/20 0.41
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CDC7 O00311 1/20 0.40
DBF4 Q9UBU7 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
SCHEMBL9370802 0.87 KDM4E (0.50) KDM4EALDH1A1ALOX15TSHRHPGD
SCHEMBL28166047 0.81 KMT2A (0.41) KDM4EALDH1A1HPGDKMT2AMEN1
SCHEMBL29501650 0.79 KDM4E (0.49) KDM4EALDH1A1ALOX15TSHRHPGD
SCHEMBL25255731 0.79 KDM4E (0.49) KDM4EALDH1A1ALOX15TSHRHPGD
SCHEMBL612735 0.79 KDM4E (0.51) KDM4EALDH1A1ALOX15TSHRHPGD
SCHEMBL277286 0.78 CYP2C9 (0.54) KDM4EALDH1A1ALOX15TSHRHPGD
SCHEMBL12458000 0.78 CA12 (0.56) KDM4EALDH1A1ALOX15TSHRHPGD
SCHEMBL20780788 0.76 KDM4E (0.49) KDM4EALDH1A1ALOX15TSHRHPGD
SCHEMBL5864153 0.76 OPRK1 (0.50) KDM4EALDH1A1ALOX15TSHRHPGD
SCHEMBL3981366 0.76 KDM4E (0.49) KDM4EALDH1A1ALOX15TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107074802-A It is used as the aryl triazoles yl pyridines of pesticide 拜耳动物保健有限责任公司 2017-08-18 CN disclosed