SCHEMBL8790507

SCHEMBL8790507

CCCCCCCC[C@@H](CO)[C@@H](C)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.54
CYP2D6 P10635 2/20 0.50
SPHK1 Q9NYA1 2/20 0.50
GMNN O75496 1/20 0.50
POLB P06746 1/20 0.50
THPO P40225 1/20 0.50
MTOR P42345 1/20 0.50
BLM P54132 1/20 0.50
KDM4E B2RXH2 1/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPT P10636 1/20 0.50
CETP P11597 1/20 0.50
HTT P42858 1/20 0.50
UBE2N P61088 1/20 0.50
GPR84 Q9NQS5 7/20 0.43
FFAR1 O14842 1/20 0.43
OPRM1 P35372 1/20 0.41
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL12491870 1.00 LMNA (0.54) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL5016073 1.00 LMNA (0.54) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL12491826 1.00 LMNA (0.54) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL12490849 1.00 LMNA (0.54) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL12491704 1.00 LMNA (0.54) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL7495807 1.00 LMNA (0.54) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL12491106 1.00 LMNA (0.54) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL16848408 1.00 LMNA (0.54) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL10609224 0.98 LMNA (0.50) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL525696 0.91 ALDH1A1 (0.46) LMNACYP2D6SPHK1GMNNPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0534258-B1 Chiral oxazolines as dopants for liquid crystals mixtures HOFFMANN LA ROCHE (CH) 1997-05-21 EP disclosed
US-5518653-A LIQUID CRYSTAL HOFFMANN-LA ROCHE INC. (US) 1996-05-21 US disclosed
EP-0457105-B1 Chiral dioxanes as components of liquid crystal mixtures HOFFMANN LA ROCHE (CH) 1995-07-26 EP disclosed
US-5360577-A MIXTURE OF OPTICALLY ACTIVE OXAZOLINE COMPOUND AND A LIQUID CRYSTALLINE CARRIER HOFFMANN-LA ROCHE INC. (US) 1994-11-01 US disclosed
EP-0534258-A1 Chiral oxazolines as dopants for liquid crystals mixtures F. HOFFMANN-LA ROCHE AG (CH) 1993-03-31 EP disclosed
EP-0457105-A1 Chiral dioxanes as components of liquid crystal mixtures F. HOFFMANN-LA ROCHE AG (CH) 1991-11-21 EP disclosed