SCHEMBL9763539

SCHEMBL9763539

CC(C)n1c(C=C[C@@H]2C[C@@H](O)CC(=O)O2)c(-c2ccc(F)cc2)c2ccccc2c1=O

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HMGCR P04035 9/20 0.52

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
SCHEMBL9763870 1.00 HMGCR (0.52) HMGCR
SCHEMBL1660811 1.00 HMGCR (0.52) HMGCR
SCHEMBL9763505 1.00 HMGCR (0.52) HMGCR
SCHEMBL5597970 1.00 HMGCR (0.52) HMGCR
SCHEMBL9763877 1.00 HMGCR (0.52) HMGCR
SCHEMBL1660810 1.00 HMGCR (0.52) HMGCR
SCHEMBL4901679 0.91 HMGCR (0.52) HMGCR
SCHEMBL4020685 0.91 HMGCR (0.52) HMGCR
SCHEMBL14544900 0.91 HMGCR (0.52) HMGCR
SCHEMBL9274196 0.91 HMGCR (0.52) 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-5004747-A Isoquinolinones MAY & BAKER LIMITED (GB) 1991-04-02 — — US claimed
US-5004747-A Isoquinolinones MAY & BAKER LIMITED (GB) 1991-04-02 — — US disclosed
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