SCHEMBL4468542

SCHEMBL4468542

CC(C)(C)OC(=O)N(CCc1ccc(C(=O)c2ccc(O[Si](C)(C)C(C)(C)C)cc2)cc1)C[C@@H](O[Si](C)(C)C(C)(C)C)c1cccc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 9/20 0.44
LPAR1 Q92633 1/20 0.36
LPAR5 Q9H1C0 1/20 0.36
GLI1 P08151 2/20 0.34
GLI2 P10070 2/20 0.34
ADRB1 P08588 5/20 0.33
PTGS1 P23219 1/20 0.32
MBTPS1 Q14703 1/20 0.31
PPARG P37231 2/20 0.30
AOC3 Q16853 1/20 0.30
PPARA Q07869 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
SCHEMBL4468537 1.00 ADRB3 (0.44) ADRB3LPAR1LPAR5GLI1GLI2
SCHEMBL4474573 0.88 ADRB3 (0.39) ADRB3LPAR1LPAR5ADRB1AOC3
SCHEMBL4474577 0.88 ADRB3 (0.39) ADRB3LPAR1LPAR5ADRB1AOC3
SCHEMBL5950226 0.80 AOC3 (0.35) ADRB3AOC3
SCHEMBL6244465 0.79 LPAR1 (0.36) ADRB3LPAR1LPAR5GLI1GLI2
SCHEMBL7716904 0.79 AOC3 (0.36) ADRB3ADRB1AOC3
SCHEMBL6238984 0.78 ADRB3 (0.46) ADRB3LPAR1LPAR5GLI1GLI2
SCHEMBL6437304 0.78 AOC3 (0.36) AOC3
SCHEMBL5949849 0.78 AOC3 (0.36) AOC3
SCHEMBL5949847 0.78 AOC3 (0.36) AOC3

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-7629366-B2 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2009-12-08 US disclosed
US-7037938-B2 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2006-05-02 US disclosed
US-20040006143-A1 For therapy of urinary incontinence FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-08 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-20040006143-A1 For therapy of urinary incontinence H1-0, HRH2, H1-2 ADRB3 568/4885LPAR1 1377/4885LPAR5 1133/4885

“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.