SCHEMBL29969698

SCHEMBL29969698

O=C(c1ccccc1)c1cccc(C(=O)C(O)c2ccccc2)c1C(=O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.59
CES2 O00748 2/20 0.59
CES1 P23141 2/20 0.59
AKR1C3 P42330 1/20 0.47
MAPK1 P28482 2/20 0.46
MAPT P10636 3/20 0.44
GAA P10253 1/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MYC P01106 1/20 0.43
TDP1 Q9NUW8 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
PTGS1 P23219 2/20 0.41
CXCR1 P25024 2/20 0.41
CXCR2 P25025 2/20 0.41
PTGS2 P35354 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RECQL P46063 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL29419383 0.88 LMNA (0.66) LMNACES2CES1AKR1C3MAPK1
SCHEMBL562163 0.88 LMNA (0.66) LMNACES2CES1AKR1C3MAPK1
SCHEMBL9781140 0.87 LMNA (0.45) LMNACES2CES1AKR1C3MAPK1
SCHEMBL27796168 0.86 LMNA (0.54) LMNACES2CES1AKR1C3MAPK1
SCHEMBL31396839 0.83 LMNA (0.59) LMNACES2CES1AKR1C3MAPK1
SCHEMBL857849 0.82 AKR1C3 (0.67) AKR1C3MAPK1MAPTGAAALDH1A1
SCHEMBL9594193 0.81 LMNA (0.49) LMNACES2CES1MAPK1MAPT
2-Benzoylbenzoic Acid SCHEMBL28364579 0.80 LMNA (0.70) LMNACES2CES1AKR1C3MAPK1
SCHEMBL9774810 0.80 AKR1C3 (0.64) AKR1C3MAPK1MAPTGAAALDH1A1
SCHEMBL11038611 0.79 LMNA (0.53) LMNACES2CES1AKR1C3MAPK1

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-115151620-A Adhesive composition layer, laminate, optical device, and method for producing optical laminate 日东电工株式会社 2022-10-04 CN disclosed