SCHEMBL6322159

SCHEMBL6322159

COC(=O)Nc1ccc(C(CCNC[C@H](O)c2ccc(O)c(NS(C)(=O)=O)c2)c2ccc(NC(=O)OC)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 20/20 0.63

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
SCHEMBL7607692 0.92 ADRB3 (0.66) ADRB3
SCHEMBL7611605 0.90 ADRB3 (0.56) ADRB3
SCHEMBL7612311 0.87 ADRB2 (0.55) ADRB3
SCHEMBL6321891 0.86 ADRB3 (0.77) ADRB3
SCHEMBL7615164 0.85 ADRB3 (0.69) ADRB3
SCHEMBL6320879 0.85 ADRB3 (0.62) ADRB3
SCHEMBL6320886 0.85 ADRB3 (0.62) ADRB3
SCHEMBL7605897 0.81 ADRB3 (0.56) ADRB3
SCHEMBL6323868 0.80 ADRB3 (0.74) ADRB3
SCHEMBL6323880 0.80 ADRB3 (0.74) ADRB3

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-20050043371-A1 Aminoalcohol derivatives and their use as beta 3 adrenergic agonists FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-02-24 US disclosed
US-20030181726-A1 Aminoalcohol derivatives and their use as beta 3 adrenergic agonists FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2003-09-25 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 (2 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-20050043371-A1 Aminoalcohol derivatives and their use as beta 3 adrenergic agonists ADRB1, ADRB3, ADRB2 ADRB3 2/4885
US-20030181726-A1 Aminoalcohol derivatives and their use as beta 3 adrenergic agonists ADRB1, ADRB3, ADRB2 ADRB3 2/4885

“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.