SCHEMBL28845182

SCHEMBL28845182

Cc1cc(C(c2ccc(C)c(O)c2C)c2ccc(C)c(O)c2C)cc(C)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
PTGS1 P23219 9/20 0.36
PTGS2 P35354 8/20 0.36
TRPA1 O75762 1/20 0.34
CACNA1C Q13936 1/20 0.34
ALOX5 P09917 7/20 0.33
MEN1 O00255 2/20 0.32
GAA P10253 2/20 0.32
KMT2A Q03164 2/20 0.32
G6PD P11413 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TTR P02766 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
PSMD14 O00487 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MMP2 P08253 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL922064 0.85 PTGS1 (0.40) ALDH1A1CA1CA2PTGS1PTGS2
SCHEMBL10585574 0.83 ALDH1A1 (0.42) ALDH1A1CA1CA2PTGS1TRPA1
SCHEMBL17445332 0.77 ESR2 (0.41) CA1CA2PTGS1PTGS2TTR
SCHEMBL673321 0.76 CA1 (0.55) ALDH1A1CA1CA2PTGS1PTGS2
SCHEMBL10051842 0.75 TDP1 (0.31) PTGS1TRPA1CACNA1CMEN1GAA
SCHEMBL1595123 0.74 CA1 (0.48) ALDH1A1CA1CA2PTGS1PTGS2
SCHEMBL920994 0.74 ALDH1A1 (0.42) ALDH1A1CA1CA2PTGS1TRPA1
SCHEMBL20808745 0.74 PTGS1 (0.41) ALDH1A1CA1CA2PTGS1PTGS2
SCHEMBL10228905 0.74 CA1 (0.37) ALDH1A1CA1CA2PTGS1PTGS2
SCHEMBL8151507 0.74 PTGS1 (0.44) ALDH1A1CA1CA2PTGS1PTGS2

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-106715597-B Resin composition, method for producing heat-resistant resin film, and display device 东丽株式会社 2022-03-01 CN disclosed
CN-106715597-A Resin composition, method for producing heat-resistant resin film, and display device 东丽株式会社 2017-05-24 CN disclosed