SCHEMBL4747685

SCHEMBL4747685

O=Cc1ccc(OCCc2coc(-c3ccccc3)n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.52
PPARG P37231 8/20 0.48
PPARA Q07869 8/20 0.48
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.42
HRH3 Q9Y5N1 1/20 0.41
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
DRD3 P35462 1/20 0.40
RAB9A P51151 1/20 0.39

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
SCHEMBL4747663 0.87 FFAR1 (0.63) FFAR1PPARGPPARAALDH1A1SMN1; SMN2
SCHEMBL7152950 0.87 PPARA (0.50) FFAR1PPARGPPARARAB9A
SCHEMBL4744208 0.85 PPARG (0.59) FFAR1PPARGPPARAHRH3
SCHEMBL5111304 0.83 FFAR1 (0.58) FFAR1PPARGPPARALMNAHRH3
SCHEMBL7210573 0.83 FFAR1 (0.52) FFAR1PPARGPPARAALDH1A1SMN1; SMN2
SCHEMBL13542481 0.82 PPARG (0.62) FFAR1PPARGPPARALMNA
SCHEMBL5099205 0.82 FFAR1 (0.60) FFAR1PPARGPPARALMNAHRH3
SCHEMBL4748088 0.81 FFAR1 (0.59) FFAR1PPARGPPARAHRH3DRD2
SCHEMBL7159209 0.81 FFAR1 (0.56) FFAR1PPARGPPARAHRH3DRD2
SCHEMBL4746580 0.81 FFAR1 (0.56) FFAR1PPARGPPARAHRH3DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008117982-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR INHIBITING LIPID ACCUMULATION CONTAINING SAME CRYSTAL GENOMICS, INC. (KR) 2008-10-02 WO disclosed
US-6541497-B1 Amino acid derivatives of benzoxazin-2-ylaminoalkoxyphenylalkyl compounds ELI LILLY AND COMPANY 2003-04-01 US disclosed
US-6353027-B1 ENANTIOMORPHIC AMINE DERIVATIVES FOR TREATMENT OF DIABETES ELI LILLY AND COMPANY 2002-03-05 US disclosed
US-6194446-B1 NON-INSULIN DEPENDENT DIABETES ELI LILLY AND COMPANY 2001-02-27 US disclosed
EP-0925063-A4 HYPOGLYCEMIC AND HYPOLIPIDEMIC COMPOUNDS LILLY CO ELI (US) 2000-12-27 EP disclosed
EP-0925063-A1 HYPOGLYCEMIC AND HYPOLIPIDEMIC COMPOUNDS ELI LILLY AND COMPANY (US) 1999-06-30 EP disclosed
WO-1998000137-A1 HYPOGLYCEMIC AND HYPOLIPIDEMIC COMPOUNDS ELI LILLY AND COMPANY (US) 1998-01-08 WO disclosed
US-5641796-A PHENYL-OXAZOLYL-ALKYLOXY OR THIO-PHENYLALKYL TRIAZOLINE-3-ONE OR THIONE ANTIDIABETIC AGENT ELI LILLY AND COMPANY (US) 1997-06-24 US disclosed