SCHEMBL5566115

SCHEMBL5566115

C[C@H](Cc1ccc(CC(=O)O)cc1)NC[C@@H](O[Si](C)(C)C(C)(C)C)c1ccc(OCc2ccccc2)c(NS(C)(=O)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 8/20 0.41
ADRB2 P07550 6/20 0.41
ADRA1D P25100 1/20 0.39
ADRA1A P35348 1/20 0.39
ADRA1B P35368 1/20 0.39
TRPV1 Q8NER1 3/20 0.39
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37

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
SCHEMBL5566113 1.00 ADRB3 (0.41) ADRB3ADRB2ADRA1DADRA1AADRA1B
SCHEMBL5034327 0.95 ADRB2 (0.47) ADRB3ADRB2ADRA1DADRA1AADRA1B
SCHEMBL5034329 0.95 ADRB2 (0.47) ADRB3ADRB2ADRA1DADRA1AADRA1B
SCHEMBL14204699 0.94 ADRB3 (0.40) ADRB3ADRB2ADRA1DADRA1AADRA1B
SCHEMBL5034398 0.92 ADRB3 (0.41) ADRB3ADRB2ADRA1DADRA1AADRA1B
SCHEMBL5034395 0.92 ADRB3 (0.41) ADRB3ADRB2ADRA1DADRA1AADRA1B
SCHEMBL14204685 0.89 ADRB2 (0.46) ADRB3ADRB2ADRA1DADRA1AADRA1B
SCHEMBL5037084 0.88 ADRB2 (0.42) ADRB3ADRB2ADRA1DADRA1AADRA1B
SCHEMBL5037087 0.88 ADRB2 (0.42) ADRB3ADRB2ADRA1DADRA1AADRA1B
SCHEMBL5563548 0.88 ADRB2 (0.47) ADRB3ADRB2TRPV1PDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1708992-B1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES PFIZER LTD (GB) 2007-08-08 EP disclosed
EP-1708992-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES Pfizer Limited (GB) 2006-10-11 EP disclosed
WO-2005080324-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES PFIZER LIMITED (GB) 2005-09-01 WO disclosed