SCHEMBL2454533

SCHEMBL2454533

CC(C)(Cc1cccc(C(=O)O)c1)NC[C@@H](O[Si](C)(C)C(C)(C)C)c1ccc(O)c(NS(C)(=O)=O)c1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 14/20 0.57
ADRB3 P13945 6/20 0.46
ADRB1 P08588 1/20 0.45

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
SCHEMBL2454530 1.00 ADRB2 (0.57) ADRB2ADRB3ADRB1
SCHEMBL12305676 0.93 ADRB2 (0.54) ADRB2ADRB3
SCHEMBL2452518 0.93 ADRB2 (0.54) ADRB2ADRB3
SCHEMBL2452521 0.93 ADRB2 (0.54) ADRB2ADRB3
SCHEMBL5707148 0.93 ADRB2 (0.54) ADRB2ADRB3
SCHEMBL2958560 0.90 ADRB2 (0.59) ADRB2ADRB3
SCHEMBL2959041 0.90 ADRB2 (0.59) ADRB2ADRB3
SCHEMBL2451868 0.89 ADRB2 (0.55) ADRB2ADRB3
SCHEMBL2451871 0.89 ADRB2 (0.55) ADRB2ADRB3
SCHEMBL3619535 0.88 ADRB2 (0.45) ADRB2ADRB3ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8013019-B2 Sulfonamide derivatives for the treatment of diseases PFIZER INC (US) 2011-09-06 US disclosed
US-20100273758-A1 Sulfonamide Derivatives For The Treatment Of Diseases BROWN ALAN DANIEL 2010-10-28 US disclosed
US-7767715-B2 Sulfonamide derivatives for the treatment of diseases PFIZER INC (US) 2010-08-03 US disclosed
US-20090197912-A1 Sulfonamide Derivatives for the Treatment of Diseases BROWN ALAN DANIEL 2009-08-06 US disclosed
US-7528170-B2 Sulfonamide derivatives for the treatment of diseases PFIZER INC. (US) 2009-05-05 US disclosed
US-20080267970-A1 Sulfonamide Derivatives For The Treatment of Diseases BROWN ALAN DANIEL 2008-10-30 US disclosed
US-7244766-B2 Sulfonamide derivatives for the treatment of diseases PFIZER INC (US) 2007-07-17 US disclosed
US-20050182091-A1 For therapy of asthma or chronic obstructive pulmonary disease (COPD) in a mammal PFIZER INC. 2005-08-18 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 (4 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-20100273758-A1 Sulfonamide Derivatives For The Treatment Of Diseases SULT2A1, STS, SULT1A1 ADRB2 2148/4885ADRB3 2520/4885ADRB1 2216/4885
US-20090197912-A1 Sulfonamide Derivatives for the Treatment of Diseases SULT2A1, STS, SULT1A1 ADRB2 2148/4885ADRB3 2520/4885ADRB1 2216/4885
US-20050182091-A1 For therapy of asthma or chronic obstructive pulmonary disease (COPD) in a mammal LTC4S, LTB4R2, LTB4R ADRB2 119/4885ADRB3 107/4885ADRB1 94/4885
US-20080267970-A1 Sulfonamide Derivatives For The Treatment of Diseases SULT2A1, STS, SULT1A1 ADRB2 2148/4885ADRB3 2520/4885ADRB1 2216/4885

“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.