SCHEMBL7254264

SCHEMBL7254264

CN(c1cccc2c1CCCC2c1cn(S(=O)(=O)N(C)C)cn1)S(C)(=O)=O

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 4/20 0.56
ADRA1A P35348 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL7098057 0.83 ADRA1A (0.55) ADRA2AADRA1A
SCHEMBL7103674 0.77 ADRA2A (0.66) ADRA2AADRA1AL3MBTL1
SCHEMBL7101564 0.69
SCHEMBL7102100 0.69 ADRA1A (0.60) ADRA2AADRA1A
Hydrochloric Acid SCHEMBL7098366 0.68 ADRA1A (0.59) ADRA2AADRA1A
SCHEMBL7098704 0.65
SCHEMBL16323587 0.64 HTT (0.34)
SCHEMBL7097810 0.63 ADRA2A (0.59) ADRA2AADRA1AMEN1ALOX15KMT2A
Hydrochloric Acid SCHEMBL7102230 0.63 ADRA2A (0.58) ADRA2AADRA1AMEN1ALOX15KMT2A
SCHEMBL7101747 0.62

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 1 patent. 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