SCHEMBL8952945

SCHEMBL8952945

CCc1c(-c2ccccc2)nc(C(C)C)c(C#CCO[PH](=O)C[C@H](CC(=O)O)O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)c1-c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.32
FABP4 P15090 2/20 0.32

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
SCHEMBL8952949 1.00 GCGR (0.32) GCGRFABP4
SCHEMBL8952912 0.94 FABP4 (0.32) FABP4
SCHEMBL8953017 0.94 HMGCR (0.31) FABP4
SCHEMBL8952904 0.94 FABP4 (0.32) FABP4
SCHEMBL8953026 0.94 HMGCR (0.31) FABP4
SCHEMBL8952855 0.92
SCHEMBL8952851 0.92
SCHEMBL8952868 0.92 FABP4 (0.31) FABP4
SCHEMBL8952860 0.92 FABP4 (0.31) FABP4
SCHEMBL8952841 0.88 NR4A2 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5506219-A ANTICHOLESTEROL AND ANTILIPEMIC AGENTS E. R. SQUIBB & SONS, INC. (US) 1996-04-09 US disclosed