SCHEMBL28567795

SCHEMBL28567795

OCCc1cccc2c1C(O)C(O)c1ccccc1-2

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.32
TDO2 P48775 1/20 0.32
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
CYP2D6 P10635 1/20 0.30
FOLH1 Q04609 1/20 0.30
PPIA P62937 1/20 0.30

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
SCHEMBL29503364 1.00 HTR2A (0.32) HTR2ATDO2PDCD1CD274TDP1
SCHEMBL2306813 0.79 TDO2 (0.47) HTR2ATDO2PDCD1CD274TDP1
SCHEMBL31275339 0.79 TDO2 (0.47) HTR2ATDO2PDCD1CD274TDP1
SCHEMBL6445670 0.76 HTR2A (0.37) HTR2ATDO2
SCHEMBL6446604 0.76 PDCD1 (0.33) HTR2ATDO2PDCD1CD274
SCHEMBL29503342 0.73 GPR3 (0.46) HTR2ACYP2D6
SCHEMBL29469331 0.73 GPR3 (0.46) HTR2ACYP2D6
SCHEMBL29469332 0.73 GPR3 (0.46) HTR2ACYP2D6
SCHEMBL6903531 0.73 GPR3 (0.46) HTR2ACYP2D6
SCHEMBL6903537 0.73 GPR3 (0.46) HTR2ACYP2D6

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-112225885-B Copolyester and preparation method thereof 万华化学集团股份有限公司 2022-04-22 CN disclosed
CN-112225885-A Copolyester and preparation method thereof 万华化学集团股份有限公司 2021-01-15 CN disclosed