SCHEMBL9063261

SCHEMBL9063261

CCOC(=O)[C@H](C)Oc1ccc(-c2ccc(-c3ccc(O[C@@H](C)C(=O)OCC)cc3)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
MAPT P10636 1/20 0.60
KMT2A Q03164 3/20 0.60
GAA P10253 3/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2C9 P11712 1/20 0.56
PKM P14618 1/20 0.56
CYP2C19 P33261 1/20 0.56
EPHX2 P34913 2/20 0.51
ALDH2 P05091 1/20 0.51
TDP1 Q9NUW8 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 2/20 0.44
POLB P06746 1/20 0.44
TSHR P16473 2/20 0.43
MAPK1 P28482 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43

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
SCHEMBL9857703 1.00 LMNA (0.63) LMNAL3MBTL1MAPTKMT2AGAA
SCHEMBL5205374 0.89 LMNA (0.63) LMNAL3MBTL1MAPTKMT2AGAA
SCHEMBL18562096 0.89 LMNA (0.63) LMNAL3MBTL1MAPTKMT2AGAA
SCHEMBL11548487 0.89 L3MBTL1 (0.63) LMNAL3MBTL1MAPTKMT2AGAA
SCHEMBL5789381 0.87 LMNA (0.66) LMNAL3MBTL1MAPTKMT2AGAA
SCHEMBL11012644 0.87 LMNA (0.70) LMNAL3MBTL1MAPTKMT2AGAA
SCHEMBL7692036 0.87 L3MBTL1 (0.61) LMNAL3MBTL1MAPTKMT2AGAA
SCHEMBL9621303 0.87 LMNA (0.66) LMNAL3MBTL1MAPTKMT2AGAA
SCHEMBL5112826 0.87 LMNA (0.61) LMNAL3MBTL1MAPTKMT2AGAA
SCHEMBL2481397 0.87 LMNA (0.66) LMNAL3MBTL1MAPTKMT2AGAA

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
EP-0407830-B1 Polarizer HOFFMANN LA ROCHE (CH) 1996-09-25 EP disclosed
EP-0405346-B1 Bistable ferroelectric liquid cristal display HOFFMANN LA ROCHE (CH) 1995-09-20 EP disclosed