SCHEMBL9753319

SCHEMBL9753319

Cc1cc(-c2ccccc2)c2c(C(C)C)c(/C=C/C(O)CC(=O)CC(=O)O)c(-c3ccc(F)cc3)nn12

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 7/20 0.43

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
SCHEMBL9753326 1.00 HMGCR (0.43) HMGCR
SCHEMBL9753589 0.91 HMGCR (0.41) HMGCR
SCHEMBL9753585 0.91 HMGCR (0.41) HMGCR
SCHEMBL9753411 0.89 HMGCR (0.53) HMGCR
SCHEMBL9753234 0.86 HMGCR (0.47) HMGCR
SCHEMBL9753235 0.86 HMGCR (0.47) HMGCR
SCHEMBL9753286 0.84 HMGCR (0.41) HMGCR
SCHEMBL9753292 0.84 HMGCR (0.41) HMGCR
SCHEMBL9753311 0.83 HMGCR (0.42) HMGCR
SCHEMBL9753308 0.83 HMGCR (0.42) 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
WO-1991018903-A1 PYRROLOPYRIDAZINE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-12-12 WO disclosed