SCHEMBL4199322

SCHEMBL4199322

C=CCOP(=O)(OCC=C)O[C@H]1[C@H](OCC[C@@H](CCCCCCC)OC)[C@@H](OCCCCCCCCCC/C=C\CCCCCC)C(O)O[C@@H]1CO

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TLR4 O00206 6/20 0.44
▸ SLC2A1 P11166 1/20 0.39
▸ ENPP2 Q13822 1/20 0.35
▸ AKT1 P31749 2/20 0.35
▸ AKT2 P31751 2/20 0.35
▸ AKT3 Q9Y243 2/20 0.35
▸ PIK3R1 P27986 1/20 0.35
▸ PIK3CA P42336 1/20 0.35
▸ LPAR3 Q9UBY5 4/20 0.34
▸ LPAR1 Q92633 3/20 0.34
▸ LPAR2 Q9HBW0 1/20 0.34
▸ S1PR1 P21453 1/20 0.34
▸ ALOX5 P09917 1/20 0.33
▸ GPR55 Q9Y2T6 1/20 0.33

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
SCHEMBL4198761 0.93 TLR4 (0.52) TLR4SLC2A1ENPP2AKT1AKT2
SCHEMBL4196560 0.91 TLR4 (0.43) TLR4ENPP2S1PR1
SCHEMBL4196562 0.91 TLR4 (0.43) TLR4ENPP2S1PR1
SCHEMBL4198240 0.90 TLR4 (0.46) TLR4ENPP2LPAR3LPAR1ALOX5
SCHEMBL4208978 0.88 TLR4 (0.44) TLR4SLC2A1ENPP2LPAR3LPAR1
SCHEMBL4193821 0.88 TLR4 (0.43) TLR4ENPP2LPAR3LPAR1LPAR2
SCHEMBL4195266 0.84 TLR4 (0.50) TLR4ENPP2LPAR3S1PR1GPR55
SCHEMBL4201319 0.84 TLR4 (0.50) TLR4ENPP2LPAR3S1PR1GPR55
SCHEMBL4201320 0.84 TLR4 (0.50) TLR4ENPP2LPAR3S1PR1GPR55
SCHEMBL4198215 0.83 TLR4 (0.41) TLR4ENPP2

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-20090062214-A1 Left-Side Glucose Lipid a Analogue SANKYO COMPANY, LTD. (JP) 2009-03-05 — — US disclosed
EP-1702926-A1 LEVULOSE GLUCOSELIPID A ANALOGUE Sankyo Company, Limited (JP) 2006-09-20 — — 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-20090062214-A1 Left-Side Glucose Lipid a Analogue SLC2A3, GPR119, SLC2A2 TLR4 294/4885SLC2A1 6/4885ENPP2 68/4885

“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.

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