SCHEMBL9696274

SCHEMBL9696274

CC(C)c1c(CCP(=O)(O)C[C@@H](O)CC(=O)O)c(-c2ccc(F)cc2)n2c1CCCC2

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.39
HMGCR P04035 3/20 0.36

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
SCHEMBL9696283 1.00 KMT2A (0.39) KMT2AHMGCR
SCHEMBL9696591 0.90 KMT2A (0.38) KMT2AHMGCR
SCHEMBL9696156 0.84 HMGCR (0.39) HMGCR
SCHEMBL9696147 0.84 HMGCR (0.39) HMGCR
SCHEMBL9697344 0.82 KMT2A (0.39) KMT2A
SCHEMBL9697349 0.82 KMT2A (0.39) KMT2A
SCHEMBL9697128 0.79 KMT2A (0.39) KMT2AHMGCR
SCHEMBL9696597 0.79 KMT2A (0.38) KMT2AHMGCR
SCHEMBL9696603 0.79 KMT2A (0.38) KMT2AHMGCR
SCHEMBL9696593 0.78 KMT2A (0.37) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0444532-A1 Phosphorus-containing HMG-CoA reductase inhibitors, new intermediates and method E.R. SQUIBB & SONS, INC. (US) 1991-09-04 EP claimed
US-5025000-A Anticholesterol, antilipemic agents E. R. SQUIBB & SONS, INC. (US) 1991-06-18 US claimed
US-5124453-A Treatment of corresponding aldehyde with lithium bis(tri-methylsilyl)amide E. R. SQUIBB & SONS, INC. (US) 1992-06-23 US disclosed
EP-0444532-A1 Phosphorus-containing HMG-CoA reductase inhibitors, new intermediates and method E.R. SQUIBB & SONS, INC. (US) 1991-09-04 EP disclosed
US-5025000-A Anticholesterol, antilipemic agents E. R. SQUIBB & SONS, INC. (US) 1991-06-18 US disclosed