SCHEMBL6806565

SCHEMBL6806565

CCOC(=O)c1cccc(Oc2ccc(S(=O)(=O)c3ccc(CCN(C[C@H](O)c4cccc(Cl)c4)C(=O)OC(C)(C)C)cc3)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 13/20 0.45
LPAR1 Q92633 1/20 0.39
LPAR5 Q9H1C0 1/20 0.39
ADRB1 P08588 7/20 0.38
BACE1 P56817 2/20 0.35
SLC2A1 P11166 1/20 0.35
GPR119 Q8TDV5 1/20 0.35

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
SCHEMBL6680864 1.00 ADRB3 (0.45) ADRB3LPAR1LPAR5ADRB1BACE1
SCHEMBL6682203 0.95 ADRB3 (0.44) ADRB3LPAR1LPAR5ADRB1BACE1
SCHEMBL6682206 0.95 ADRB3 (0.44) ADRB3LPAR1LPAR5ADRB1BACE1
SCHEMBL6805016 0.93 ADRB3 (0.47) ADRB3LPAR1LPAR5ADRB1SLC2A1
SCHEMBL6682294 0.93 ADRB3 (0.47) ADRB3LPAR1LPAR5ADRB1SLC2A1
SCHEMBL6540663 0.92 CYP4F2 (0.36) ADRB3BACE1
SCHEMBL6540667 0.92 CYP4F2 (0.36) ADRB3BACE1
SCHEMBL6677324 0.91 ADRB3 (0.55) ADRB3LPAR1LPAR5ADRB1
SCHEMBL6541363 0.91 TP53 (0.40) ADRB3ADRB1BACE1
SCHEMBL6541360 0.91 TP53 (0.40) ADRB3ADRB1BACE1

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 ADRB3 150/4885LPAR1 1110/4885LPAR5 1485/4885

“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.