SCHEMBL6367193

SCHEMBL6367193

CCCCNC(=O)c1cc(F)ccc1NCC1=NCCN1

nearest known ligand 0.76

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADRA1A P35348 20/20 0.76
▸ ADRA1D P25100 17/20 0.76
▸ ADRA1B P35368 17/20 0.76
▸ ADRA2A P08913 4/20 0.55
▸ ADRA2C P18825 3/20 0.54
▸ ADRA2B P18089 2/20 0.54

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
Hydrochloric Acid SCHEMBL6367748 0.99 ADRA1A (0.74) ADRA1AADRA1DADRA1BADRA2AADRA2C
SCHEMBL6366831 0.86 ADRA1A (1.00) ADRA1AADRA1DADRA1B
Hydrochloric Acid SCHEMBL6367046 0.85 ADRA1A (0.98) ADRA1AADRA1DADRA1BADRA2C
SCHEMBL6366626 0.83 ADRA1A (0.94) ADRA1AADRA1DADRA1B
SCHEMBL6366856 0.82 ADRA1A (0.74) ADRA1AADRA1DADRA1BADRA2AADRA2C
Hydrochloric Acid SCHEMBL7632791 0.80 ADRA1A (0.53) ADRA1AADRA1DADRA1BADRA2AADRA2C
SCHEMBL6367171 0.79 ADRA1A (1.00) ADRA1AADRA1DADRA1B
Hydrochloric Acid SCHEMBL6367642 0.78 ADRA1A (0.98) ADRA1AADRA1DADRA1BADRA2C
SCHEMBL6367306 0.74 ADRA1A (1.00) ADRA1AADRA1DADRA1B
Propane SCHEMBL6367133 0.73 ADRA1A (0.66) ADRA1AADRA1DADRA1BADRA2AADRA2C

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-6884801-B1 Imidazoline derivatives as alpha-1A adrenoceptor ligands SMITHKLINE BEECHAM CORPORATION (US) 2005-04-26 — — US disclosed
EP-1175406-A1 IMIDAZOLINE DERIVATIVES AS ALPHA-1A ADRENOCEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2002-01-30 — — EP disclosed
WO-2000066563-A1 IMIDAZOLINE DERIVATIVES AS ALPHA-1A ADRENOCEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2000-11-09 — — WO disclosed
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