SCHEMBL8551082

SCHEMBL8551082

CCCCCCCCC(Cc1ccccc1)(C(=O)OCC)C(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
RECQL P46063 1/20 0.51
MMP8 P22894 1/20 0.51
AMPD3 Q01432 1/20 0.48
PPARA Q07869 2/20 0.47
PPARG P37231 1/20 0.47
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PTPRC P08575 1/20 0.44
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPRB P23467 1/20 0.44
PTPRG P23470 1/20 0.44
ACP1 P24666 1/20 0.44
CETP P11597 3/20 0.43
PIN1 Q13526 1/20 0.43
MBOAT4 Q96T53 1/20 0.42

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
SCHEMBL20507240 0.93 MEN1 (0.48) ALDH1A1RECQLMMP8AMPD3PPARA
SCHEMBL20507259 0.93 MEN1 (0.48) ALDH1A1RECQLMMP8AMPD3PPARA
SCHEMBL20507238 0.93 MEN1 (0.48) ALDH1A1RECQLMMP8AMPD3PPARA
SCHEMBL20507257 0.93 MEN1 (0.48) ALDH1A1RECQLMMP8AMPD3PPARA
SCHEMBL20507255 0.93 MEN1 (0.48) ALDH1A1RECQLMMP8AMPD3PPARA
SCHEMBL20507247 0.91 MEN1 (0.45) ALDH1A1RECQLMMP8AMPD3PPARA
SCHEMBL28845888 0.89 LMNA (0.44) ALDH1A1RECQLMMP8AMPD3L3MBTL1
SCHEMBL28123735 0.89 TSHR (0.49) ALDH1A1RECQLMMP8AMPD3L3MBTL1
SCHEMBL31147059 0.89 TSHR (0.49) ALDH1A1RECQLMMP8AMPD3PPARG
SCHEMBL20507235 0.86 PTPRB (0.45) ALDH1A1RECQLMMP8AMPD3PPARA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0546338-B1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KK (JP) 1998-02-04 EP disclosed
US-5385692-A Improved response CANON KABUSHIKI KAISHA (JP) 1995-01-31 US disclosed
EP-0546338-A1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1993-06-16 EP disclosed