SCHEMBL9736971

SCHEMBL9736971

CCn1c(=O)n(C)c(=O)c2c(-c3ccc(F)cc3)c(C=C[C@H]3C[C@H](O)CC(=O)O3)c(C(C)C)nc21

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 12/20 0.60

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
SCHEMBL9383849 1.00 HMGCR (0.60) HMGCR
SCHEMBL9383858 1.00 HMGCR (0.60) HMGCR
SCHEMBL9736966 1.00 HMGCR (0.60) HMGCR
SCHEMBL9383855 1.00 HMGCR (0.60) HMGCR
SCHEMBL9378233 0.83 HMGCR (0.64) HMGCR
SCHEMBL10398500 0.83 HMGCR (0.77) HMGCR
SCHEMBL9734648 0.80 DPP4 (0.42) HMGCR
SCHEMBL9387195 0.80 DPP4 (0.42) HMGCR
SCHEMBL9871180 0.79 HMGCR (0.69) HMGCR
SCHEMBL9870588 0.78 HMGCR (0.69) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5145959-A Enzyme inhibitors; antilipemic agents; treatment of atherosclerosis BAYER AKTIENGESELLSCHAFT (DE) 1992-09-08 US disclosed
US-5075311-A Anticholesterol agents BAYER AKTIENGESELLSCHAFT (DE) 1991-12-24 US disclosed