SCHEMBL4512959

SCHEMBL4512959

CCCCCCCCCCCCCCCCCC[C@@H](O)C1OC(C)(C)OC1C

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.36
SPHK1 Q9NYA1 1/20 0.36
GMNN O75496 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
THPO P40225 1/20 0.36
MTOR P42345 1/20 0.36
BLM P54132 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
CETP P11597 1/20 0.36
HTT P42858 1/20 0.36
UBE2N P61088 1/20 0.36
GBA1 P04062 3/20 0.35

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
SCHEMBL12332279 0.78 LMNA (0.38) LMNATHPOCYP1A2
SCHEMBL51260 0.78 EBP (0.41) SPHK1GBA1
SCHEMBL51615 0.76 EBP (0.38) GBA1
SCHEMBL28559828 0.76 DAGLA (0.32) CYP2D6SPHK1GMNNLMNAPOLB
SCHEMBL11960077 0.73 GPR84 (0.39) SPHK1GBA1
SCHEMBL18658557 0.73
SCHEMBL15381137 0.72 SPHK1 (0.39) CYP2D6SPHK1GMNNLMNAPOLB
SCHEMBL12302384 0.72 DAGLA (0.38) CYP2D6SPHK1GMNNLMNAPOLB
SCHEMBL16559181 0.72 DAGLA (0.38) CYP2D6SPHK1GMNNLMNAPOLB
SCHEMBL11981257 0.71 GBA1 (0.37) GBA1

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
US-20090227781-A1 Glycolipid Derivative and Drug Containing the Same as Active Component JAPAN AS REPRESENTED BY PRESIDENT OF NATIONAL CENTER OF NEUROLOGY AND PSYCHIATRY (JP) 2009-09-10 US disclosed
EP-1905766-A1 GLYCOLIPID DERIVATIVE AND THERAPEUTIC AGENT COMPRISING THE SAME AS ACTIVE INGREDIENT Japan as represented by President of National Center of Neurology and Psychiatry (JP) 2008-04-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090227781-A1 Glycolipid Derivative and Drug Containing the Same as Active Component CD4, UGCG, HRH2 CYP2D6 678/4885SPHK1 135/4885GMNN 3361/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.