SCHEMBL8091302

SCHEMBL8091302

CC(C)=CCOc1ccc(Cl)c2c1CCN(C)CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 7/20 1.00
ADRA2B P18089 7/20 1.00
ADRA2C P18825 7/20 1.00
ADRA1D P25100 5/20 1.00
ADRA1A P35348 5/20 1.00
ADRA1B P35368 5/20 1.00
CYP2D6 P10635 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
HTR1A P08908 1/20 0.38
TRPA1 O75762 1/20 0.37
MTNR1A P48039 1/20 0.37

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
SCHEMBL29389267 1.00 ADRA2A (1.00) ADRA2AADRA2BADRA2CADRA1DADRA1A
Maleic Acid SCHEMBL10723245 0.92 ADRA2A (0.84) ADRA2AADRA2BADRA2CADRA1DADRA1A
Fumaric Acid SCHEMBL10349229 0.92 ADRA2A (0.84) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL10350070 0.87 ADRA2A (0.77) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL10349589 0.84 ADRA2A (0.72) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL10349233 0.83 ADRA2A (1.00) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL10349231 0.82 ADRA2A (0.70) ADRA2AADRA2BADRA2CADRA1DADRA1A
Hydrochloric Acid SCHEMBL10349227 0.82 ADRA2A (0.97) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL8911267 0.80 ADRA2A (0.66) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL8911888 0.79 ADRA2A (0.65) ADRA2AADRA2BADRA2CADRA1DADRA1A

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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238281-B1 SELECTIVE ALPHA-ADRENERGIC RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1990-05-16 EP claimed
EP-0238281-A1 Selective alpha-adrenergic receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1987-09-23 EP claimed
US-4683229-A HYPOTENSIVE AGENTS SMITHKLINE BECKMAN CORPORATION (US) 1987-07-28 US claimed
US-6162455-A Method for increasing lean meat, improving the lean meat to fat ratio and improving amino acid utilization in warm-blooded animals AMERICAN CYANAMID COMPANY (US) 2000-12-19 US disclosed
US-5639748-A HYPOTENSIVE AGENTS SMITHKLINE BEECHAM CORPORATION (US) 1997-06-17 US disclosed
US-5599810-A ADMINISTERING IN TREATMENT OF BENIGN PROSTATIC HYPERTROPHY, PERIPHERAL VASCULAR DISEASE AND CONGESTIVE HEART FAILURE SMITHKLINE BEECHAM CORPORATION (US) 1997-02-04 US disclosed
EP-0684949-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1995-12-06 EP disclosed
EP-0684949-A4 CHEMICAL COMPOUNDS. SMITHKLINE BEECHAM CORP (US) 1995-10-13 EP disclosed
EP-0630372-A1 HETEROALKOXY BENZAZEPINES SMITHKLINE BEECHAM CORPORATION (US) 1994-12-28 EP disclosed
EP-0344982-B1 Alpha-adrenergic receptor antagonists SMITHKLINE BEECHAM CORP (US) 1994-11-23 EP disclosed
EP-0344979-B1 Alfa-adrenergic receptor antagonists SMITHKLINE BEECHAM CORP (US) 1994-11-09 EP disclosed
WO-1989012051-A1 alpha-ADRENERGIC RECEPTOR ANTAGONISTS SMITHKLINE BECKMAN CORPORATION (US) 1989-12-14 WO disclosed
WO-1989012054-A1 alpha-ADRENERGIC RECEPTOR ANTAGONISTS SMITHKLINE BECKMAN CORPORATION (US) 1989-12-14 WO disclosed
WO-1989012053-A1 alpha-ADRENERGIC RECEPTOR ANTAGONISTS SMITHKLINE BECKMAN CORPORATION (US) 1989-12-14 WO disclosed
EP-0344980-A2 Alpha-adrenergic receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1989-12-06 EP disclosed
EP-0344982-A2 Alpha-adrenergic receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1989-12-06 EP disclosed
EP-0344981-A2 Alpha-adrenergic receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1989-12-06 EP disclosed
EP-0344979-A2 Alfa-adrenergic receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1989-12-06 EP disclosed
EP-0238281-A1 Selective alpha-adrenergic receptor antagonists SMITHKLINE BEECHAM CORPORATION (US) 1987-09-23 EP disclosed
US-4683229-A HYPOTENSIVE AGENTS SMITHKLINE BECKMAN CORPORATION (US) 1987-07-28 US disclosed