SCHEMBL4290322

SCHEMBL4290322

CCC(C)(C)C(=O)C(CSC)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.33
RNPEP Q9H4A4 1/20 0.32
FOLH1 Q04609 1/20 0.32
RIPK1 Q13546 2/20 0.30

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
SCHEMBL1666550 0.82 RNPEP (0.46) RNPEPFOLH1
SCHEMBL17433678 0.80 CA2 (0.37) RIPK1
SCHEMBL1664400 0.77 RIPK1 (0.31) RIPK1
SCHEMBL474110 0.77 ENPEP (0.35) RIPK1
SCHEMBL8460951 0.75 TSHR (0.32) RIPK1
SCHEMBL4949678 0.74 RNPEP (0.44) KIF11RNPEPFOLH1
SCHEMBL14470035 0.72 MAPK1 (0.39)
SCHEMBL4053641 0.71 TP53 (0.33) RNPEPRIPK1
SCHEMBL8461977 0.70 RNPEP (0.33) RNPEP
SCHEMBL23383641 0.68 RIPK1 (0.31) RIPK1

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
US-9970037-B2 Methods and materials for making simvastatin and related compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-05-15 US disclosed
US-20150203884-A1 METHODS AND MATERIALS FOR MAKING SIMVASTATIN AND RELATED COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2015-07-23 US disclosed
US-8951754-B2 Methods and materials for making simvastatin and related compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-02-10 US disclosed
US-20120315680-A1 METHODS AND MATERIALS FOR MAKING SIMVASTATIN AND RELATED COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-12-13 US disclosed
US-8211664-B2 Methods and materials for making simvastatin and related compounds THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-07-03 US disclosed
US-20090191602-A1 Methods and Materials for Making Simvastatin and Related Compounds INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2009-07-30 US disclosed