SCHEMBL4986530

SCHEMBL4986530

Cc1c(CC2=NCCN2)ccc(NS(C)(=O)=O)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 10/20 0.50
HTR1D P28221 6/20 0.50
HTR1B P28222 5/20 0.50
ADRA1D P25100 8/20 0.46
ADRA1B P35368 8/20 0.46
ADRA2C P18825 7/20 0.46
ADRA2A P08913 6/20 0.46
ADRA2B P18089 1/20 0.43
TAAR1 Q96RJ0 3/20 0.41
RAD52 P43351 1/20 0.39

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
SCHEMBL14092053 0.89 HTR1D (0.49) ADRA1AHTR1DHTR1BADRA1DADRA1B
SCHEMBL2387364 0.87 ADRA1A (0.45) ADRA1AHTR1DHTR1BADRA1DADRA1B
Hydrochloric Acid SCHEMBL3726001 0.86 ADRA1A (0.44) ADRA1AHTR1DHTR1BADRA1DADRA1B
SCHEMBL2561416 0.86 HTR1D (0.50) ADRA1AHTR1DHTR1BADRA1DADRA1B
SCHEMBL4992395 0.86 HTR1D (0.50) ADRA1AHTR1DHTR1BADRA1DADRA1B
SCHEMBL13752307 0.86 HTR1D (0.50) ADRA1AHTR1DHTR1BADRA1DADRA1B
Hydrochloric Acid SCHEMBL3726850 0.85 HTR1D (0.49) ADRA1AHTR1DHTR1BADRA1DADRA1B
SCHEMBL14092049 0.85 HTR1D (0.49) ADRA1AHTR1DHTR1BADRA1DADRA1B
SCHEMBL5200810 0.84 TAAR1 (0.51) ADRA1AHTR1DADRA1DADRA1BADRA2C
SCHEMBL4993251 0.84 HTR1B (0.48) ADRA1AHTR1DHTR1BADRA1DADRA1B

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
US-7407980-B2 Imidazolinylmethyl aralkylsulfonamides ROCHE PALO ALTO LLC (US) 2008-08-05 US disclosed
US-7407980-B2 Imidazolinylmethyl aralkylsulfonamides ROCHE PALO ALTO LLC (US) 2008-08-05 US disclosed
US-7407980-B2 Imidazolinylmethyl aralkylsulfonamides ROCHE PALO ALTO LLC (US) 2008-08-05 US disclosed