SCHEMBL9318925

SCHEMBL9318925

COCc1c(-c2ccc(F)cc2)c(/C=C/C(O)CC(=O)CC(=O)OC)c(C(C)C)n(C)c1=O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 6/20 0.49
ESR1 P03372 1/20 0.49
CHRM1 P11229 1/20 0.49
TBXA2R P21731 1/20 0.49
PDE4A P27815 1/20 0.49
ADRA1A P35348 1/20 0.49
GCGR P47871 1/20 0.36

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
SCHEMBL9662629 0.93 HMGCR (0.53) HMGCRESR1CHRM1TBXA2RPDE4A
SCHEMBL9662639 0.93 HMGCR (0.53) HMGCRESR1CHRM1TBXA2RPDE4A
SCHEMBL9318838 0.91 HMGCR (0.48) HMGCRESR1CHRM1TBXA2RPDE4A
SCHEMBL9320893 0.90 HMGCR (0.41) HMGCRESR1CHRM1TBXA2RPDE4A
SCHEMBL9664038 0.84 HMGCR (0.52) HMGCRESR1CHRM1TBXA2RPDE4A
SCHEMBL9664033 0.84 HMGCR (0.52) HMGCRESR1CHRM1TBXA2RPDE4A
SCHEMBL9665217 0.83 HMGCR (0.42) HMGCRESR1CHRM1TBXA2RPDE4A
SCHEMBL9665214 0.83 HMGCR (0.42) HMGCRESR1CHRM1TBXA2RPDE4A
SCHEMBL10650833 0.82 HMGCR (0.46) HMGCRESR1CHRM1TBXA2RPDE4A
SCHEMBL8953431 0.79 HMGCR (0.61) HMGCRESR1CHRM1TBXA2RPDE4A

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-0373423-B1 Substituted 2-pyridones and pyride-2-thiones, process for their preparation and their use in medicine BAYER AG (DE) 1994-01-12 EP disclosed