SCHEMBL7943703

SCHEMBL7943703

COc1ccccc1C1c2ccccc2C(c2ccc3c(c2)OCO3)C1C(=O)O

nearest known ligand 0.78

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 16/20 0.78
EDNRA P25101 16/20 0.78
FABP7 O15540 2/20 0.54
FABP3 P05413 2/20 0.54
FABP5 Q01469 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
SCHEMBL7943708 0.88 EDNRA (0.79) EDNRBEDNRA
SCHEMBL7942483 0.88 EDNRA (0.79) EDNRBEDNRA
SCHEMBL7942478 0.88 EDNRA (0.79) EDNRBEDNRA
SCHEMBL7538026 0.87 EDNRA (1.00) EDNRBEDNRA
SCHEMBL6452207 0.87 EDNRA (1.00) EDNRBEDNRA
SCHEMBL6452202 0.87 EDNRA (1.00) EDNRBEDNRA
SCHEMBL8626049 0.86 EDNRA (0.59) EDNRBEDNRAFABP7FABP3FABP5
SCHEMBL7942494 0.85 EDNRA (0.80) EDNRBEDNRA
SCHEMBL7533846 0.85 EDNRA (0.83) EDNRBEDNRA
SCHEMBL7531491 0.83 EDNRA (0.73) EDNRBEDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6271399-B1 METHYL 3-(3,4-METHYLENEDIOXYPHENYL)-6-(PROP-1-YLOXY)-INDANE-2-CARBOXYLATE DERIVATIVES SMITHKLINE BEECHAM CORPORATION 2001-08-07 US disclosed
US-6087389-A TREATING CARDIOVASCULAR AND RENAL DISEASES INCLUDING HYPERTENSION, ACUTE AND CHRONIC RENAL FAILURE, CYCLOSPORINE INDUCED NEPHROTOXICITY, STROKE, CEREBROVASCULAR VASOSPASM, MYOCARDIAL ISCHEMIA, ANGINA, HEART FAILURE, ATHEROSCLEROSIS SMITHKLINE BEECHAM CORPORATION (US) 2000-07-11 US disclosed
US-5817693-A Endothelin receptor antagonists SMITHKLINE BEECHAM CORPORATION 1998-10-06 US disclosed
US-5719183-A HYPOTENSIVE AGENTS; KIDNEY DISEASES; ANTIISCHEMIC AGENTS SMITHKLINE BEECHAM CORPORATION (US) 1998-02-17 US disclosed
US-5719182-A TREATING HYPERTENSION, RENAL FAILURE, CEREBROVASCULAR DISEASE SMITHKLINE BEECHAM CORPORATION (US) 1998-02-17 US disclosed
US-5716984-A INDANE AND INDENE DERIVATIVES; TREATMENT OF CARDIOVASCULAR DISORDERS, KIDNEY DISORDERS SMITHKLINE BEECHAM CORPORATION (US) 1998-02-10 US disclosed