SCHEMBL5155532

SCHEMBL5155532

CCC(N)(CC)c1ccc(CC(NC(=O)CC(NS(=O)(=O)c2ccc3ccccc3c2)c2ccccc2)C(=O)N2CCCC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 7/20 0.58
BDKRB2 P30411 3/20 0.54
F2 P00734 3/20 0.51
PLG P00747 1/20 0.51
PLAU P00749 1/20 0.51
F10 P00742 1/20 0.51

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
SCHEMBL5155432 0.92 BDKRB1 (0.62) BDKRB1BDKRB2F2PLGPLAU
SCHEMBL5151471 0.90 BDKRB1 (0.53) BDKRB1BDKRB2F2
SCHEMBL4697387 0.89 F2 (0.64) BDKRB1BDKRB2F2PLGPLAU
Hydrochloric Acid SCHEMBL5151160 0.89 BDKRB1 (0.48) BDKRB1F2PLGPLAUF10
Hydrochloric Acid SCHEMBL5151629 0.88 F2 (0.63) BDKRB1BDKRB2F2PLGPLAU
SCHEMBL5171843 0.88 BDKRB1 (0.62) BDKRB1BDKRB2F2PLGPLAU
Hydrochloric Acid SCHEMBL5150900 0.88 BDKRB1 (0.60) BDKRB1BDKRB2F2PLGPLAU
SCHEMBL5231459 0.88 BDKRB1 (0.60) BDKRB1BDKRB2F2PLGPLAU
SCHEMBL5155814 0.87 BDKRB1 (0.63) BDKRB1BDKRB2F2PLGPLAU
SCHEMBL5155469 0.87 BDKRB1 (0.56) BDKRB1BDKRB2

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
EP-1373233-B1 DERIVATIVES OF N-(ARYLSULFONYL)BETA-AMINOACIDS COMPRISING A SUBSTITUTED AMINOMETHYL GROUP, THE PREPARATION METHOD THEREOF AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI AVENTIS (FR) 2007-09-05 EP disclosed
US-7157454-B2 Derivatives of n-(arylsulfonyl)beta-aminoacids comprising a substituted aminomethyl group, the preparation method thereof and the pharmaceutical compositions containing same SANOFI-AVENTIS (FR) 2007-01-02 US disclosed
US-20040116353-A1 Derivatives of n-(arylsulfonyl)beta-aminoacids comprising a substituted aminomethyl group, the preparation method thereof and the pharmaceutical compositions containing same SANOFI (FR) 2004-06-17 US disclosed
EP-1373233-A1 DERIVATIVES OF N-(ARYLSULFONYL)BETA-AMINOACIDS COMPRISING A SUBSTITUTED AMINOMETHYL GROUP, THE PREPARATION METHOD THEREOF AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Sanofi-Aventis (FR) 2004-01-02 EP disclosed
WO-2002076964-A1 DERIVATIVES OF N-(ARYLSULFONYL)BETA-AMINOACIDS COMPRISING A SUBSTITUTED AMINOMETHYL GROUP, THE PREPARATION METHOD THEREOF AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2002-10-03 WO disclosed