SCHEMBL5489394

SCHEMBL5489394

CCCCCCCCCCCCCCCCC(C)C(O)CCO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.52
LMNA P02545 4/20 0.48
CYP2D6 P10635 2/20 0.48
TP53 P04637 2/20 0.48
GMNN O75496 1/20 0.48
POLB P06746 1/20 0.48
THPO P40225 1/20 0.48
MTOR P42345 1/20 0.48
BLM P54132 1/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
CETP P11597 1/20 0.48
HTT P42858 1/20 0.48
UBE2N P61088 1/20 0.48
PTPN1 P18031 1/20 0.45
OPRM1 P35372 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL18457223 1.00 SPHK1 (0.52) SPHK1LMNACYP2D6TP53GMNN
SCHEMBL13817351 0.98 SPHK1 (0.48) SPHK1LMNACYP2D6TP53GMNN
SCHEMBL30018032 0.98 SPHK1 (0.48) SPHK1LMNACYP2D6TP53GMNN
SCHEMBL1685177 0.91 SPHK1 (0.40) SPHK1LMNACYP2D6TP53GMNN
Octacosanol SCHEMBL3907484 0.89 SPHK1 (0.55) SPHK1LMNACYP2D6TP53GMNN
SCHEMBL1122256 0.89 SPHK1 (0.64) SPHK1LMNACYP2D6TP53GMNN
SCHEMBL18186112 0.89 SPHK1 (0.64) SPHK1LMNACYP2D6TP53GMNN
SCHEMBL18186110 0.89 SPHK1 (0.64) SPHK1LMNACYP2D6TP53GMNN
SCHEMBL1123628 0.89 SPHK1 (0.64) SPHK1LMNACYP2D6TP53GMNN
SCHEMBL20856812 0.89 SPHK1 (0.64) SPHK1LMNACYP2D6TP53GMNN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070037061-A1 Polymer electrolyte complex THE UNIVERSITY OF SHEFFIELD (GB) 2007-02-15 US disclosed
US-20070009805-A1 Polymer electrolyte THE UNIVERSITY OF SHEFFIELD (GB) 2007-01-11 US disclosed
WO-2006051323-A1 POLYMER ELECTROLYTE THE UNIVERSITY OF SHEFFIELD (GB) 2006-05-18 WO disclosed
EP-1623474-A2 POLYMER ELECTROLYTE COMPLEX THE UNIVERSITY OF SHEFFIELD (GB) 2006-02-08 EP disclosed
EP-1623475-A2 POLYMER ELECTROLYTE COMPLEX The University Of Sheffield (GB) 2006-02-08 EP disclosed
WO-2004102692-A2 POLYMER ELECTROLYTE COMPLEX THE UNIVERSITY OF SHEFFIELD (GB) 2004-11-25 WO disclosed
WO-2004102693-A2 POLYMER ELECTROLYTE COMPLEX THE UNIVERSITY OF SHEFFIELD (GB) 2004-11-25 WO disclosed