SCHEMBL10445787

SCHEMBL10445787

CCCCCCCCC(=O)OC1(C(=O)OC[C@@H](Cl)C(C)C)C=CC(c2ccccc2)C=C1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.34
PPARG P37231 3/20 0.33
TLR2 O60603 3/20 0.33
POLM Q9NP87 1/20 0.32
POLK Q9UBT6 1/20 0.32
POLL Q9UGP5 1/20 0.32
POLH Q9Y253 1/20 0.32
ALDH1A1 P00352 2/20 0.32
ASAH1 Q13510 1/20 0.32
ACER2 Q5QJU3 1/20 0.32
ALOX15 P16050 1/20 0.32
LMNA P02545 3/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32

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
SCHEMBL8380021 0.81 CES2 (0.40) PPARGPOLMPOLKPOLLPOLH
SCHEMBL9331791 0.81 CES2 (0.40) PPARGPOLMPOLKPOLLPOLH
SCHEMBL9574875 0.79 CES2 (0.38) MAPTPPARGPOLMPOLKPOLL
SCHEMBL9842927 0.76 CES2 (0.40) PPARGPOLMPOLKPOLLPOLH
SCHEMBL11034473 0.74 PPARG (0.40) MAPTPPARGALDH1A1LMNA
SCHEMBL10445788 0.72 POLM (0.32) MAPTTLR2POLMPOLKPOLL
SCHEMBL10973192 0.72 TP53 (0.42) MAPTPPARGLMNA
SCHEMBL10903892 0.71 PPARG (0.48) PPARGALDH1A1LMNAKDM4E
SCHEMBL9852394 0.68 PPARG (0.43) MAPTPPARGALDH1A1LMNAKDM4E
SCHEMBL4184936 0.68 PPARG (0.45) MAPTPPARGALDH1A1LMNAKDM4E

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
EP-0351782-A2 Optically active compounds liquid crystal composition containing said compound, and liquid crystal optical modulator using said composition HITACHI, LTD. (JP) 1990-01-24 EP disclosed