SCHEMBL10691499

SCHEMBL10691499

CC(=O)c1ccc(OC(CCCCC(=O)O)c2ccc(Cc3ccccc3)cc2)cc1O

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOB P27338 15/20 0.51
PPARD Q03181 1/20 0.46
MAOA P21397 4/20 0.42

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
SCHEMBL10691549 0.91 MAOB (0.51) MAOBPPARD
SCHEMBL10694013 0.89 PPARD (0.47) MAOBPPARD
SCHEMBL10687692 0.79 CYSLTR2 (0.52) PPARD
SCHEMBL10693512 0.77 PPARD (0.52) MAOBPPARDMAOA
SCHEMBL10693027 0.74 PPARD (0.49) MAOBPPARDMAOA
SCHEMBL10687936 0.71 PPARD (0.71) MAOBPPARDMAOA
SCHEMBL21052036 0.70 PPARD (0.74) MAOBPPARDMAOA
SCHEMBL7907683 0.70 MAOB (0.56) MAOB
SCHEMBL7907678 0.70 MAOB (0.56) MAOB
SCHEMBL10691999 0.70 CYSLTR2 (0.42) PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4769482-A Cyano and thiocyano intermediates ELI LILLY AND COMPANY (US) 1988-09-06 US disclosed
EP-0108592-B1 LEUKOTRIENE ANTAGONISTS ELI LILLY AND COMPANY (US) 1987-09-30 EP disclosed
US-4661505-A 4-(4-ACETYL-3-HYDROXY-2-PROPYLPHENOXY) ALKANOIC ACIDS, TETRAZOLES, AND DERIVATIVES ELI LILLY AND COMPANY (US) 1987-04-28 US disclosed
EP-0108592-A1 Leukotriene antagonists ELI LILLY AND COMPANY (US) 1984-05-16 EP disclosed