SCHEMBL30337232

SCHEMBL30337232

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

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.68
POLB P06746 1/20 0.68
APEX1 P27695 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
RARB P10826 4/20 0.59
MAPK1 P28482 1/20 0.55
TP53 P04637 1/20 0.55
TSHR P16473 1/20 0.55
PLA2G4B P0C869 6/20 0.53
PLA2G4A P47712 1/20 0.49
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.47
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL27373667 1.00 HTT (0.68) HTTPOLBAPEX1TDP1RARB
SCHEMBL28981009 0.85 HTT (0.65) HTTPOLBAPEX1TDP1RARB
SCHEMBL30337406 0.84 HTT (0.64) HTTPOLBAPEX1TDP1RARB
SCHEMBL28981030 0.84 TP53 (0.65) HTTPOLBAPEX1TDP1RARB
SCHEMBL30337241 0.84 HTT (0.64) HTTPOLBAPEX1TDP1RARB
SCHEMBL30337477 0.82 RARB (0.59) HTTPOLBAPEX1TDP1RARB
SCHEMBL10428461 0.81 HTT (1.00) HTTPOLBAPEX1TDP1RARB
SCHEMBL1309117 0.81 HTT (1.00) HTTPOLBAPEX1TDP1RARB
SCHEMBL8962574 0.81 HTT (1.00) HTTPOLBAPEX1TDP1RARB
SCHEMBL8682933 0.81 HTT (1.00) HTTPOLBAPEX1TDP1RARB

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