SCHEMBL3259409

SCHEMBL3259409

COC(=O)C[C@H]1C[C@@H](/C=C/c2c(-c3ccc(F)cc3)nc(NCS(C)(=O)=O)nc2C(C)C)OC(C)(C)O1

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HMGCR P04035 12/20 0.46

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
SCHEMBL2034579 0.94 HMGCR (0.46) HMGCR
SCHEMBL3162906 0.94 HMGCR (0.44) HMGCR
SCHEMBL2050591 0.94 HMGCR (0.46) HMGCR
SCHEMBL3167877 0.93 HMGCR (0.47) HMGCR
SCHEMBL3964715 0.93 HMGCR (0.47) HMGCR
Methylamine SCHEMBL3171804 0.92 HMGCR (0.46) HMGCR
SCHEMBL3259413 0.86 HMGCR (0.56) HMGCR
SCHEMBL13100382 0.86 HMGCR (0.56) HMGCR
SCHEMBL16568794 0.86 HMGCR (0.44) HMGCR
SCHEMBL17073105 0.85 HMGCR (0.46) HMGCR

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
EP-1902036-B1 PROCESS FOR THE PREPARATION OF ROSUVASTATIN AND INTERMEDIATES RICHTER GEDEON NYRT (HU) 2010-03-24 — — EP disclosed
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