SCHEMBL4620342

SCHEMBL4620342

O=C(O)c1cc(OC/C=C/COc2cc(C(=O)O)nc3ccc(F)cc23)c2cc(F)ccc2n1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.43
ALDH1A1 P00352 3/20 0.42
PDE10A Q9Y233 1/20 0.39
DHODH Q02127 9/20 0.39
GAA P10253 1/20 0.39
IDO1 P14902 2/20 0.38
IGFBP5 P24593 1/20 0.37

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
SCHEMBL4620353 1.00 ALOX15 (0.43) ALOX15ALDH1A1PDE10ADHODHGAA
SCHEMBL5704021 0.99 ALOX15 (0.42) ALOX15ALDH1A1PDE10ADHODHGAA
SCHEMBL5704026 0.92 ALDH1A1 (0.40) ALOX15ALDH1A1PDE10ADHODHIDO1
SCHEMBL5704033 0.92 ALDH1A1 (0.40) ALOX15ALDH1A1PDE10ADHODHIDO1
SCHEMBL14255066 0.91 IGFBP5 (0.39) ALOX15ALDH1A1PDE10ADHODHGAA
SCHEMBL4622456 0.91 ALDH1A1 (0.37) ALOX15ALDH1A1PDE10ADHODHGAA
SCHEMBL4622498 0.90 TSHR (0.42) ALOX15ALDH1A1PDE10ADHODHGAA
SCHEMBL4621902 0.87 ALOX15 (0.42) ALOX15ALDH1A1PDE10ADHODHIDO1
SCHEMBL4620763 0.85 PDE10A (0.52) ALOX15ALDH1A1PDE10ADHODHGAA
SCHEMBL5097600 0.83 ALOX15 (0.42) ALOX15ALDH1A1PDE10ADHODHGAA

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
US-7470708-B2 Acidic quinoline derivatives and their use for the prevention and/or treatment of hyperglycaemia-related pathologies MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2008-12-30 US claimed
EP-1696924-B1 ACIDIC QUINOLINE DERIVATIVES AND THEIR USE FOR THE PREVENTION AND/OR TREATMENT OF HYPERGLYCAEMIA-RELATED PATHOLOGIES MERCK PATENT GMBH (DE) 2008-03-26 EP claimed
US-7470708-B2 Acidic quinoline derivatives and their use for the prevention and/or treatment of hyperglycaemia-related pathologies MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2008-12-30 US disclosed
US-7470708-B2 Acidic quinoline derivatives and their use for the prevention and/or treatment of hyperglycaemia-related pathologies MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2008-12-30 US disclosed
US-7470708-B2 Acidic quinoline derivatives and their use for the prevention and/or treatment of hyperglycaemia-related pathologies MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2008-12-30 US disclosed
EP-1696924-B1 ACIDIC QUINOLINE DERIVATIVES AND THEIR USE FOR THE PREVENTION AND/OR TREATMENT OF HYPERGLYCAEMIA-RELATED PATHOLOGIES MERCK PATENT GMBH (DE) 2008-03-26 EP disclosed
EP-1696924-A1 ACIDIC QUINOLINE DERIVATIVES AND THEIR USE FOR THE PREVENTION AND/OR TREATMENT OF HYPERGLYCAEMIA-RELATED PATHOLOGIES MERCK PATENT GmbH (DE) 2006-09-06 EP disclosed
WO-2005063244-A1 ACIDIC QUINOLINE DERIVATIVES AND THEIR USE FOR THE PREVENTION AND/OR TREATMENT OF HYPERGLYCAEMIA-RELATED PATHOLOGIES MERCK PATENT GMBH (DE) 2005-07-14 WO disclosed