SCHEMBL28404148

SCHEMBL28404148

COc1ccccc1C(=O)NCc1cccc(C)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.74
TP53 P04637 2/20 0.74
GLA P06280 1/20 0.74
ALDH1A1 P00352 4/20 0.67
KDM4E B2RXH2 2/20 0.67
HSD17B10 Q99714 1/20 0.67
POLB P06746 1/20 0.64
LMNA P02545 4/20 0.60
RAB9A P51151 2/20 0.60
NPC1 O15118 1/20 0.60
ADORA2A P29274 1/20 0.58
CHRM3 P20309 1/20 0.58
USP2 O75604 1/20 0.56
KCNK3 O14649 1/20 0.55
KCNK9 Q9NPC2 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 1/20 0.55

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
SCHEMBL29936750 1.00 HPGD (0.74) HPGDTP53GLAALDH1A1KDM4E
SCHEMBL13040229 0.86 HPGD (0.74) HPGDTP53GLAALDH1A1KDM4E
SCHEMBL29617703 0.86 HPGD (0.74) HPGDTP53GLAALDH1A1KDM4E
SCHEMBL18641776 0.86 HPGD (0.74) HPGDTP53GLAALDH1A1KDM4E
SCHEMBL15686112 0.86 HPGD (0.83) HPGDTP53GLAALDH1A1KDM4E
SCHEMBL27604453 0.86 HPGD (1.00) HPGDTP53GLAALDH1A1KDM4E
SCHEMBL28498838 0.85 HPGD (0.72) HPGDTP53GLAALDH1A1POLB
SCHEMBL29809770 0.85 HPGD (0.72) HPGDTP53GLAALDH1A1POLB
SCHEMBL12993471 0.83 HPGD (0.69) HPGDTP53GLAALDH1A1KDM4E
SCHEMBL17339403 0.83 HPGD (0.69) HPGDTP53GLAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112203515-B Application of N-benzyl benzamide compound as herbicide 西北农林科技大学 2022-08-02 CN disclosed
CN-112203515-A Application of N-benzyl benzamide compound as herbicide 西北农林科技大学 2021-01-08 CN disclosed
CN-111202068-A N-benzyl benzamide compound and preparation method and application thereof 西北农林科技大学 2020-05-29 CN disclosed