SCHEMBL29065636

SCHEMBL29065636

CCCCCCCCCCCCCCCCCCc1cc(-c2ccccc2)c(O)c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.44
GCGR P47871 2/20 0.44
MAPT P10636 3/20 0.43
MEN1 O00255 2/20 0.43
HTT P42858 2/20 0.43
KMT2A Q03164 2/20 0.43
TYR P14679 2/20 0.43
ALOX5 P09917 2/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
KDM4E B2RXH2 2/20 0.42
ESR1 P03372 2/20 0.42
APAF1 O14727 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 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
SCHEMBL27927810 0.87 GCGR (0.47) LIPGGCGRMAPTMEN1HTT
SCHEMBL5988340 0.85 ELANE (0.49) LIPGGCGRMAPTMEN1HTT
SCHEMBL31099234 0.84 PDE4B (0.41) LIPGGCGRMAPTMEN1HTT
SCHEMBL2864920 0.81 ALOX5 (0.54) LIPGMAPTMEN1HTTKMT2A
SCHEMBL27578017 0.80 ELANE (0.53) LIPGGCGRMAPTMEN1HTT
SCHEMBL10869835 0.80 ALOX5 (0.49) LIPGGCGRMAPTMEN1HTT
SCHEMBL8649812 0.79 TYR (0.45) LIPGGCGRMAPTMEN1HTT
SCHEMBL2855437 0.79 ALOX5 (0.53) LIPGMAPTMEN1HTTKMT2A
Ethane SCHEMBL28101928 0.79 TYR (0.44) MAPTMEN1HTTKMT2ATYR
SCHEMBL202228 0.78 PTGS2 (0.53) LIPGTP53CYP3A4KDM4EESR1

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-114426761-B Biodegradable polyester material and method for producing same 财团法人工业技术研究院 2023-09-08 CN disclosed