SCHEMBL7141794

SCHEMBL7141794

C=CCO[C@H]1O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H](OCC[C@@H](CCCCCCCCCCC)OCc2ccc(OC)cc2)[C@H]1NC(=O)OCC(Cl)(Cl)Cl

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TLR4 O00206 2/20 0.35
▸ MCHR1 Q99705 11/20 0.32
▸ SSTR3 P32745 5/20 0.32
▸ SSTR5 P35346 5/20 0.32
▸ SSTR2 P30874 3/20 0.31
▸ SSTR1 P30872 1/20 0.31
▸ SSTR4 P31391 1/20 0.31
▸ TBXAS1 P24557 1/20 0.30

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
SCHEMBL7141796 0.95 TLR4 (0.32) TLR4TBXAS1
SCHEMBL7137272 0.91 TLR4 (0.35) TLR4MCHR1SSTR3SSTR5
SCHEMBL7137280 0.91 TLR4 (0.35) TLR4MCHR1SSTR3SSTR5
SCHEMBL7141715 0.90 TLR4 (0.38) TLR4
SCHEMBL7136889 0.89 SLC5A1 (0.36) TLR4MCHR1SSTR3SSTR5SSTR2
SCHEMBL7143787 0.89 TLR4 (0.33) TLR4
SCHEMBL7143793 0.89 TLR4 (0.33) TLR4
SCHEMBL7141720 0.84 TLR4 (0.34) TLR4
SCHEMBL7136893 0.83 SLC5A1 (0.33) TLR4
SCHEMBL7144653 0.81 TLR4 (0.36) TLR4MCHR1SSTR3SSTR5SSTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6511965-B2 For therapy and prophylaxis of inflammatory disorders, autoimmune diseases or septicemia SANKYO COMPANY, LIMITED (JP) 2003-01-28 — — US disclosed
US-20020161221-A1 Ether type lipid a 1-carboxylic acid analogs SANKYO COMPANY, LIMITED (JP) 2002-10-31 — — US disclosed
EP-1152007-A1 ETHER TYPE LIPID A1-CARBOXYLIC ACID ANALOGUES Sankyo Company, Limited (JP) 2001-11-07 — — 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-20020161221-A1 Ether type lipid a 1-carboxylic acid analogs MSR1, ELOVL1, FFAR1 TLR4 296/4885MCHR1 1873/4885SSTR3 1755/4885

“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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