SCHEMBL9700569

SCHEMBL9700569

COc1ccc(CCNCC(O)CO)cc1OC

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 9/20 0.66
ADRB1 P08588 8/20 0.64
LMNA P02545 3/20 0.64
SLC6A4 P31645 2/20 0.64
SLC6A3 Q01959 2/20 0.64
ALDH1A1 P00352 1/20 0.64
NPSR1 Q6W5P4 1/20 0.64
SLC22A1 O15245 1/20 0.64
CHRM2 P08172 1/20 0.64
CYP3A4 P08684 1/20 0.64
CHRM1 P11229 1/20 0.64
TSHR P16473 1/20 0.64
NFKB1 P19838 1/20 0.64
OPRM1 P35372 1/20 0.64
HIF1A Q16665 1/20 0.64
ADRB3 P13945 7/20 0.63
KMT2A Q03164 2/20 0.63
OXTR P30559 1/20 0.63
AVPR1A P37288 1/20 0.63
HTT P42858 1/20 0.63

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
SCHEMBL9700731 1.00 ADRB2 (0.66) ADRB2ADRB1LMNASLC6A4SLC6A3
Sulfuric Acid SCHEMBL10570655 0.94 ADRB3 (0.62) ADRB2ADRB1LMNASLC6A4SLC6A3
SCHEMBL10553168 0.92 STAT3 (0.57) ADRB2ADRB1LMNASLC6A4SLC6A3
SCHEMBL11498377 0.91 KMT2A (0.57) ADRB2ADRB1LMNASLC6A4SLC6A3
SCHEMBL11202332 0.87 ADRB2 (0.64) ADRB2ADRB1LMNASLC6A4SLC6A3
SCHEMBL11429165 0.87 ADRB2 (0.65) ADRB2ADRB1LMNASLC6A4SLC6A3
SCHEMBL7308971 0.87 KMT2A (0.65) ADRB2ADRB1LMNASLC6A4SLC6A3
SCHEMBL10674081 0.85 ADRB2 (0.62) ADRB2ADRB1LMNASLC6A4SLC6A3
SCHEMBL11432735 0.84 CA12 (0.48) ADRB2ADRB1LMNASLC6A4SLC6A3
SCHEMBL1970148 0.82 ADRB2 (0.64) ADRB2ADRB1LMNASLC6A4SLC6A3

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5082939-A Pyridazine derivatives I.S.F. SOCIETA PER AZIONI (IT) 1992-01-21 US disclosed
US-4873328-A Process for preparing alkoxyalkylidenehydrazinopyridazine derivatives I.S.F. SOCIETA PER AZIONI (IT) 1989-10-10 US disclosed
EP-0274409-A2 Process for preparing alkoxyalkyl-idenehydrazinopyridazine derivatives I.S.F. Socièta per Azioni (IT) 1988-07-13 EP disclosed
EP-0081580-B1 COMPOSITIONS FOR TREATING GLAUCOMA AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1987-04-22 EP disclosed
US-4604481-A Compounds for treatment or prophylaxis of cardiac disorders AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1986-08-05 US disclosed
US-4501912-A AMINO-2-HYDROXYROPYLBENZOATE COMPOUND OR SALT WITH LONG DURATION IN OCULAR FLUID; RAPID METABOLISM AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1985-02-26 US disclosed
EP-0081580-A4 COMPOSITIONS FOR TREATING GLAUCOMA. AMERICAN HOSPITAL SUPPLY CORP (US) 1983-12-01 EP disclosed
US-4405642-A BETA-BLOCKING AROMATIC ESTER COMPOUND AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1983-09-20 US disclosed
US-4402974-A WITH CARBOXY, OXY, CARBO-AMINE AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1983-09-06 US disclosed
EP-0081580-A1 COMPOSITIONS FOR TREATING GLAUCOMA. AMERICAN HOSPITAL SUPPLY CORP (US) 1983-06-22 EP disclosed
WO-1983000043-A1 COMPOSITIONS FOR TREATING GLAUCOMA AMERICAN HOSPITAL SUPPLY CORP (US) 1983-01-06 WO disclosed
EP-0053436-A1 Method for treatment or prophylaxis of cardiac disorders AMERICAN HOSPITAL SUPPLY CORPORATION (US) 1982-06-09 EP disclosed
US-4263307-A N-Aralkyl containing cyanopyridines MERCK & CO., INC. (US) 1981-04-21 US disclosed
EP-0014951-A2 Heterocyclic oxypropanolamine derivatives, process for their preparation and medicines containing these compounds Roche Diagnostics GmbH (DE) 1980-09-03 EP disclosed
US-4208416-A N-Aralkyl containing cyanopyridines MERCK & CO., INC. (US) 1980-06-17 US disclosed
EP-0007448-A1 Pyridyloxypropanolamines and esters thereof, process for preparing the same and pharmaceutical compositions containing them MERCK & CO. INC. (US) 1980-02-06 EP disclosed
US-4165374-A ANTIARRHYTHMIA, ANTILEPEMIC, HYPOGLYCEMIC SANDOZ LTD. (CH) 1979-08-21 US disclosed