SCHEMBL28609672

SCHEMBL28609672

Cc1cccc(C(Cc2ccccc2)C(N)=O)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.71
POLB P06746 2/20 0.49
ACP3 P15309 1/20 0.45
TDP1 Q9NUW8 3/20 0.45
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
CHRM1 P11229 5/20 0.43
UBE2N P61088 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
CTSL P07711 1/20 0.43
CTSB P07858 1/20 0.43
CTSS P25774 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL29608984 1.00 EPHX1 (0.71) EPHX1POLBACP3TDP1PPARG
SCHEMBL29609668 0.91 EPHX1 (0.71) EPHX1POLBACP3TDP1CHRM1
SCHEMBL28605746 0.91 EPHX1 (0.71) EPHX1POLBACP3TDP1CHRM1
Hydrochloric Acid SCHEMBL23880738 0.84 EPHX1 (0.47) EPHX1POLBACP3TDP1PPARG
SCHEMBL1516139 0.84 EPHX1 (1.00) EPHX1POLBACP3CHRM1UBE2N
SCHEMBL621911 0.83 EPHX1 (0.73) EPHX1POLBCHRM1UBE2NALDH1A1
SCHEMBL10269752 0.83 EPHX1 (0.73) EPHX1CHRM1UBE2N
SCHEMBL11019097 0.83 EPHX1 (0.73) EPHX1CHRM1UBE2NKDM4E
SCHEMBL11021257 0.83 EPHX1 (0.77) EPHX1CHRM1UBE2NALDH1A1MEN1
SCHEMBL28107950 0.83 EPHX1 (0.77) EPHX1POLBPPARGPPARACHRM1

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-113214104-B Method for synthesizing aromatic acetamide 浙江工业大学 2022-05-24 CN disclosed
CN-113214104-A Method for synthesizing aromatic acetamide 浙江工业大学 2021-08-06 CN disclosed