SCHEMBL13058693

SCHEMBL13058693

CCCCCCCCCCCCCCCCO[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)O[C@@H]1C(O[C@@H]2OC(CO)[C@H](O)[C@H](O)C2O)C(O)[C@@H](O)[C@H](O)C1O

nearest known ligand 0.97

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 4/20 0.56
PLCG2 P16885 1/20 0.54
GPR55 Q9Y2T6 1/20 0.54
SMPD1 P17405 1/20 0.53
NR5A2 O00482 1/20 0.49
NR5A1 Q13285 1/20 0.49
AKT2 P31751 2/20 0.47
AKT3 Q9Y243 2/20 0.47
PIK3R1 P27986 1/20 0.47
PIK3CA P42336 1/20 0.47

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
SCHEMBL13058689 1.00 AKT1 (0.56) AKT1PLCG2GPR55SMPD1NR5A2
SCHEMBL13058699 1.00 AKT1 (0.56) AKT1PLCG2GPR55SMPD1NR5A2
SCHEMBL13058682 0.98 AKT1 (0.56) AKT1PLCG2GPR55SMPD1NR5A2
SCHEMBL13058685 0.98 AKT1 (0.56) AKT1PLCG2GPR55SMPD1NR5A2
SCHEMBL13058687 0.95 AKT1 (0.53) AKT1PLCG2GPR55SMPD1NR5A2
SCHEMBL12285595 0.92 PLCG2 (0.65) AKT1PLCG2GPR55SMPD1NR5A2
SCHEMBL30898873 0.92 PLCG2 (0.65) AKT1PLCG2GPR55SMPD1NR5A2
SCHEMBL15090908 0.92 PLCG2 (0.65) AKT1PLCG2GPR55SMPD1NR5A2
SCHEMBL13058760 0.91 AKT1 (0.49) AKT1PLCG2GPR55SMPD1AKT2
SCHEMBL13058764 0.90 AKT1 (0.48) AKT1PLCG2GPR55SMPD1

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
US-20100297156-A1 ANALOGUES OF PHOSPHATIDYLINOSITOL MANNOSIDES INDUSTRIAL RESEARCH LIMITED (NZ) 2010-11-25 US 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-20100297156-A1 ANALOGUES OF PHOSPHATIDYLINOSITOL MANNOSIDES PIK3CA, PIK3CB, PIK3CG AKT1 260/4885PLCG2 16/4885GPR55 1688/4885

“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.