SCHEMBL6803595

SCHEMBL6803595

CCOC(=O)c1cc(S(=O)(=O)c2ccc(CCN(C[C@@H](O)c3cccc(Cl)c3)C(=O)OC(C)(C)C)cc2)ccc1NC

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 5/20 0.37
ADRB3 P13945 7/20 0.34
ADRB1 P08588 4/20 0.34
ADRB2 P07550 1/20 0.34
LMNA P02545 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
SCHEMBL6677142 1.00 BACE1 (0.37) BACE1ADRB3ADRB1ADRB2LMNA
SCHEMBL6804191 0.94 BACE1 (0.36) BACE1ADRB3ADRB1ADRB2LMNA
SCHEMBL6804189 0.94 BACE1 (0.36) BACE1ADRB3ADRB1ADRB2LMNA
SCHEMBL6799290 0.93 BACE1 (0.37) BACE1ADRB3ADRB1ADRB2
SCHEMBL6799287 0.93 BACE1 (0.37) BACE1ADRB3ADRB1ADRB2
SCHEMBL6806124 0.92 ADRB3 (0.35) BACE1ADRB3ADRB1ADRB2
SCHEMBL6805478 0.92 ADRB3 (0.35) BACE1ADRB3ADRB1ADRB2
SCHEMBL6806128 0.92 ADRB3 (0.35) BACE1ADRB3ADRB1ADRB2
SCHEMBL6805473 0.92 ADRB3 (0.35) BACE1ADRB3ADRB1ADRB2
SCHEMBL6676378 0.91 BACE1 (0.40) BACE1ADRB3ADRB1

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-20040106653-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-03 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-20040106653-A1 Aminoalcohol derivatives FANCD2, FANCI, HRH2 BACE1 4413/4885ADRB3 150/4885ADRB1 39/4885

“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.