SCHEMBL11182020

SCHEMBL11182020

O=C(CO)CCC/C=C\CC1=CC(O)CC1=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 1/20 0.33

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
SCHEMBL17421815 0.87 TOP1 (0.47) TOP1
SCHEMBL1083220 0.87 TOP1 (0.47) TOP1
SCHEMBL11234405 0.87 TOP1 (0.47) TOP1
SCHEMBL11573698 0.87 TOP1 (0.47) TOP1
SCHEMBL11451513 0.87 TOP1 (0.47) TOP1
SCHEMBL1083217 0.87 TOP1 (0.47) TOP1
SCHEMBL11341829 0.86 TOP1 (0.30) TOP1
SCHEMBL11216573 0.85 TOP1 (0.35) TOP1
SCHEMBL11244757 0.84
SCHEMBL11883787 0.83 PTGER2 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4390711-A 16-Hydroxy-5-iodo-prostacyclin analogs of the 1 series AMERICAN CYANAMID COMPANY (US) 1983-06-28 US disclosed
US-4265904-A BRONCHODILATOR AGENTS AMERICAN CYANAMID COMPANY (US) 1981-05-05 US disclosed
US-4254285-A 1-Hydroxymethyl-1-1-oxo prostane derivatives of the E and F series AMERICAN CYANAMID COMPANY (US) 1981-03-03 US disclosed
US-4254036-A 1-Hydroxymethyl-1-oxo-prostane-derivatives of the E, A and F-series AMERICAN CYANAMID COMPANY (US) 1981-03-03 US disclosed
US-4235797-A CHEMICAL INTERMEDIATES FOR PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1980-11-25 US disclosed
US-4235924-A BRONCHODILATION, PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1980-11-25 US disclosed
EP-0015056-A1 1-Hydroxymethyl-1-oxo-prostane derivatives of the E, A and F series AMERICAN CYANAMID COMPANY (US) 1980-09-03 EP disclosed
US-4212969-A PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1980-07-15 US disclosed
US-4202822-A PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1980-05-13 US disclosed
US-4197245-A 1-Hydroxymethyl-1-oxo-prostane derivatives of the A1 series AMERICAN CYANAMID COMPANY (US) 1980-04-08 US disclosed
US-4172839-A PROSTAGLANDINS AMERICAN CYANAMID COMPANY (US) 1979-10-30 US disclosed
US-4170597-A 1-Hydroxymethyl-1-oxo-prostane derivatives of the E2 series AMERICAN CYANAMID COMPANY (US) 1979-10-09 US disclosed
EP-0002590-A1 Novel prostaglandin compounds, processes for the preparation thereof and pharmaceutical compositions containing them AMERICAN CYANAMID COMPANY (US) 1979-06-27 EP disclosed