SCHEMBL28850201

SCHEMBL28850201

O=C1C[C@H](C(=O)O)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.53
EDNRA P25101 4/20 0.50
EDNRB P24530 3/20 0.50
GLS O94925 1/20 0.47
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ADORA3 P0DMS8 2/20 0.41
AR P10275 2/20 0.41
HSD11B1 P28845 1/20 0.41
AKR1C3 P42330 1/20 0.41
S100A4 P26447 1/20 0.40
P2RX7 Q99572 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP19A1 P11511 1/20 0.40
MAOB P27338 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL916737 1.00 ALDH1A1 (0.53) ALDH1A1EDNRAEDNRBGLSMEN1
SCHEMBL15107233 0.83 GLS (0.46) ALDH1A1EDNRAEDNRBGLSMEN1
SCHEMBL4931874 0.83 GLS (0.46) ALDH1A1EDNRAEDNRBGLSMEN1
SCHEMBL15129174 0.83 GLS (0.46) ALDH1A1EDNRAEDNRBGLSMEN1
SCHEMBL15129443 0.83 GLS (0.46) ALDH1A1EDNRAEDNRBGLSMEN1
SCHEMBL8562417 0.83 GLS (0.46) ALDH1A1EDNRAEDNRBGLSMEN1
SCHEMBL28003100 0.81 EDNRB (0.43) ALDH1A1EDNRAEDNRBGLSSMN1; SMN2
SCHEMBL6796657 0.81 EDNRB (0.43) ALDH1A1EDNRAEDNRBGLSSMN1; SMN2
SCHEMBL13485801 0.80 GLS (0.53) EDNRAEDNRBGLSMEN1KMT2A
SCHEMBL9489554 0.80 EDNRB (0.47) ALDH1A1EDNRAEDNRBMEN1KMT2A

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-115103907-A Compositions and methods for enhancing immune activity 金橘生物科技公司 2022-09-23 CN disclosed