SCHEMBL7966754

SCHEMBL7966754

O=C(O)C(c1ccccc1)c1cccc(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
ACP3 P15309 1/20 0.54
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CACNA2D1 P54289 2/20 0.43
CACNA1B Q00975 2/20 0.43
CACNB1 Q02641 2/20 0.43
CACNA1C Q13936 2/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
CACNA1G O43497 1/20 0.43

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
SCHEMBL11000344 0.96 MEN1 (0.54) MEN1KMT2AACP3KEAP1NFE2L2
SCHEMBL22917201 0.85 MEN1 (0.53) MEN1KMT2AACP3NPC1LMNA
SCHEMBL9337191 0.82 CNR1 (0.56) MEN1KMT2ALMNATDP1L3MBTL1
SCHEMBL23031986 0.81 MEN1 (0.52) MEN1KMT2AACP3LMNAALDH1A1
SCHEMBL23031959 0.81 MEN1 (0.49) MEN1KMT2AACP3NPC1LMNA
Diphenylacetic Acid SCHEMBL38022 0.81 SRC (0.62) MEN1KMT2ALMNATDP1L3MBTL1
Diphenylacetic Acid SCHEMBL8513250 0.81 SRC (0.62) MEN1KMT2ALMNATDP1L3MBTL1
SCHEMBL9492209 0.80 SRC (0.58) MEN1KMT2AACP3KEAP1NFE2L2
Diphenylacetic Acid SCHEMBL6852183 0.79 SRC (0.59) MEN1KMT2ALMNATDP1L3MBTL1
Diphenylacetic Acid SCHEMBL8411440 0.79 SRC (0.59) MEN1KMT2ALMNATDP1L3MBTL1

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-115073383-B Synthesis method of aryl acetic acid compound 四川大学 2023-07-18 CN disclosed
CN-115073383-A Synthetic method of aryl acetic acid compound 四川大学 2022-09-20 CN disclosed
WO-2001002364-A1 NEW NPY ANTAGONISTS ASTRAZENECA AB (SE) 2001-01-11 WO disclosed