SCHEMBL7248372

SCHEMBL7248372

CCS(=O)(=O)Nc1cccc2c1CCCC2c1csc(N)n1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 4/20 0.58
ADRA1A P35348 3/20 0.49

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
SCHEMBL7254003 0.82 ADRA2A (0.59) ADRA2AADRA1A
SCHEMBL7254879 0.82 ADRA2A (0.64) ADRA2AADRA1A
SCHEMBL7247757 0.81 ADRA2A (0.60) ADRA2AADRA1A
SCHEMBL7254230 0.79 ADRA2A (0.62) ADRA2AADRA1A
SCHEMBL7097624 0.78 ADRA2A (0.65) ADRA2AADRA1A
SCHEMBL7100485 0.77 ADRA2A (0.66) ADRA2AADRA1A
SCHEMBL7102952 0.74 ADRA2A (0.62) ADRA2AADRA1A
Fumaric Acid SCHEMBL7103323 0.72 ADRA2A (0.57) ADRA2AADRA1A
Maleic Acid SCHEMBL7103315 0.72 ADRA2A (0.57) ADRA2AADRA1A
SCHEMBL7102121 0.72 ADRA2A (0.68) ADRA2AADRA1A

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-6503935-B1 Treating urinary incontinence or retrograde ejaculation ABBOTT LABORATORIES 2003-01-07 US disclosed
EP-1102754-A1 IMIDAZOLES AND RELATED COMPOUNDS AS ALPHA-1A AGONISTS ABBOTT LABORATORIES (US) 2001-05-30 EP disclosed
WO-2000007997-A1 IMIDAZOLES AND RELATED COMPOUNDS AS α1A AGONISTS ABBOTT LABORATORIES (US) 2000-02-17 WO disclosed