SCHEMBL7557523

SCHEMBL7557523

Cc1nc(C)c(CO)c(-c2ccc(F)cc2)n1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GCGR P47871 13/20 0.47
EGLN1 Q9GZT9 1/20 0.44
DHODH Q02127 1/20 0.43
MAPK14 Q16539 1/20 0.38
DPP4 P27487 1/20 0.38

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
SCHEMBL9788388 0.80 DPP4 (0.56) GCGRDHODHDPP4
SCHEMBL8949698 0.79 GCGR (0.56) GCGRDPP4
SCHEMBL10411663 0.75 EGLN1 (0.39) GCGREGLN1MAPK14
SCHEMBL286403 0.75 GABRA5 (0.52)
SCHEMBL6956576 0.75 GCGR (0.46) GCGRDHODHDPP4
SCHEMBL17613419 0.74 HMGCR (0.46) GCGR
SCHEMBL10410199 0.73 EGLN1 (0.48) EGLN1DHODH
SCHEMBL10735986 0.72 KDM4E (0.37) EGLN1
SCHEMBL6590702 0.71 EGLN1 (0.46) GCGREGLN1DHODHMAPK14
SCHEMBL8846678 0.71 ADORA2A (0.38) GCGREGLN1MAPK14

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
EP-0705837-B1 Preparation of 3-Oxy-5-oxo-6-heptenoic acid derivatives UBE INDUSTRIES (JP) 2002-08-07 EP disclosed
US-5744604-A Preparation of 3-oxy-5-oxo-6-heptenoic acid derivatives UBE INDUSTRIES, LTD. (JP) 1998-04-28 US disclosed
US-5677455-A Preparation of 3-oxy-5-oxo-6-heptenoic acid derivatives UBE INDUSTRIES, LTD. (JP) 1997-10-14 US disclosed
EP-0705837-A2 Preparation of 3-Oxy-5-oxo-6-heptenoic acid derivatives UBE INDUSTRIES, LTD. (JP) 1996-04-10 EP disclosed
US-4929620-A ANTILIPEMIC AGENTS WARNER-LAMBERT COMPANY (US) 1990-05-29 US disclosed
US-4868185-A HYPOLIPIDEMIC, ANTICHOLESTEROL WARNER-LAMBERT COMPANY (US) 1989-09-19 US disclosed