SCHEMBL30337455

SCHEMBL30337455

C=CC(=O)OC(CCC)CCCCCOc1ccc(C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.58
TSHR P16473 1/20 0.58
PLA2G4B P0C869 7/20 0.56
RARB P10826 5/20 0.54
PLA2G4A P47712 1/20 0.52
HTT P42858 3/20 0.51
ALDH1A1 P00352 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
POLB P06746 1/20 0.48
APEX1 P27695 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL29269217 0.95 TP53 (0.65) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL30337210 0.95 TP53 (0.61) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL29217475 0.92 TP53 (0.56) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL27921852 0.87 ALDH1A1 (0.53) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL6317041 0.86 PLA2G4B (0.56) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL30337477 0.84 RARB (0.59) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL2036318 0.84 RARB (0.55) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL30337241 0.84 HTT (0.64) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL5512485 0.83 PLA2G4B (0.52) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL28858688 0.83 NPC1 (0.53) TP53TSHRPLA2G4BRARBPOLB

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-115916853-B Polymer, and photo-alignment film and retardation film using the same 大阪有机化学工业株式会社 2024-07-09 CN disclosed
CN-115916853-A Novel polymer, and photo-alignment film and retardation film using same 大阪有机化学工业株式会社 2023-04-04 CN disclosed