SCHEMBL28295913

SCHEMBL28295913

O=C(O)c1ccccc1COc1cccc2c1OCO2

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.57
HTT P42858 1/20 0.57
FOLH1 Q04609 4/20 0.56
ALDH1A1 P00352 1/20 0.50
MRGPRX4 Q96LA9 2/20 0.49
KDM4C Q9H3R0 1/20 0.46
ALKBH1 Q13686 1/20 0.45
CLCN2 P51788 1/20 0.44
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MTNR1A P48039 3/20 0.42
MEN1 O00255 1/20 0.41
CTNNB1 P35222 1/20 0.41
WNT3A P56704 1/20 0.41
FABP3 P05413 1/20 0.41
FABP4 P15090 1/20 0.41
FABP5 Q01469 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
SCHEMBL28294082 0.85 FOLH1 (0.41) TP53HTTFOLH1ALDH1A1MRGPRX4
SCHEMBL31482063 0.79 HTT (0.64) TP53HTTFOLH1ALDH1A1MRGPRX4
SCHEMBL10522223 0.79 MAOB (0.53) TP53FOLH1ALDH1A1KMT2ATDP1
SCHEMBL28325500 0.79 MTNR1A (0.44) ALDH1A1KDM4CALKBH1KMT2ATDP1
SCHEMBL28001740 0.78 HIF1A (0.46) FOLH1MTNR1ACTNNB1WNT3A
SCHEMBL29442138 0.76 KDM4C (0.52) ALDH1A1KDM4CCTNNB1WNT3AFABP3
SCHEMBL340702 0.76 KDM4C (0.52) ALDH1A1KDM4CCTNNB1WNT3AFABP3
SCHEMBL28326574 0.75 TP53 (0.40) TP53HTTKMT2ATDP1L3MBTL1
Hydrochloric Acid SCHEMBL9236405 0.75 KDM4C (0.51) ALDH1A1KDM4CCTNNB1WNT3AFABP3
SCHEMBL28295914 0.75 KMT2A (0.40) ALDH1A1ALKBH1KMT2ATDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110396054-A A kind of green synthesis method of kresoxim-methyl JINGBO AGROCHEMICALS TECH CO LTD 2019-11-01 CN disclosed
CN-109651190-A A kind of synthetic method of kresoxim-methyl 京博农化科技有限公司 2019-04-19 CN disclosed