SCHEMBL6329655

SCHEMBL6329655

Cc1nc(-c2ccc(CC(C)(C)NC[C@H](O)c3ccc(Cl)c(NS(C)(=O)=O)c3)cc2)cs1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 5/20 0.76
ADRB2 P07550 13/20 0.53
HPGD P15428 1/20 0.44
ADRB1 P08588 1/20 0.43

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
SCHEMBL6329659 1.00 ADRB3 (0.76) ADRB3ADRB2HPGDADRB1
SCHEMBL6336211 0.90 ADRB3 (0.77) ADRB3ADRB2ADRB1
SCHEMBL6336213 0.90 ADRB3 (0.77) ADRB3ADRB2ADRB1
SCHEMBL6326153 0.89 ADRB3 (0.64) ADRB3ADRB2ADRB1
SCHEMBL6326159 0.89 ADRB3 (0.64) ADRB3ADRB2ADRB1
SCHEMBL6334520 0.81 ADRB3 (0.77) ADRB3ADRB2HPGDADRB1
SCHEMBL6336730 0.81 ADRB3 (0.77) ADRB3ADRB2HPGDADRB1
SCHEMBL6328720 0.79 ADRB3 (0.51) ADRB3ADRB2ADRB1
SCHEMBL6337986 0.75 ADRB3 (0.72) ADRB3ADRB2ADRB1
SCHEMBL27575428 0.75 ADRB3 (0.72) ADRB3ADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050075323-A1 Beta3 adrenergic receptor agonists and uses thereof PFIZER INC 2005-04-07 US disclosed
US-6706743-B2 β3 adrenergic receptor agonists and uses thereof PFIZER INC 2004-03-16 US disclosed
US-20030203913-A1 Beta3 adrenergic receptor agonists and uses thereof PFIZER INC. 2003-10-30 US disclosed
US-6566377-B2 β3 adrenergic receptor agonists and uses thereof PFIZER INC. 2003-05-20 US disclosed
US-20020052392-A1 Bita3 adrenergic receptor agonists and uses thereof DAY ROBERT F (US) 2002-05-02 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 (3 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-20030203913-A1 Beta3 adrenergic receptor agonists and uses thereof ADRB3, ADRB1, ADRB2 ADRB3 1/4885ADRB2 3/4885HPGD 2660/4885
US-20050075323-A1 Beta3 adrenergic receptor agonists and uses thereof ADRB3, ADRB1, ADRB2 ADRB3 1/4885ADRB2 3/4885HPGD 2765/4885
US-20020052392-A1 Bita3 adrenergic receptor agonists and uses thereof ADRB3, ADRA1A, ADRB1 ADRB3 1/4885ADRB2 4/4885HPGD 3015/4885

“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.