SCHEMBL11210375

SCHEMBL11210375

CC(=O)SCC(C)(C)C(=O)N1CC2(C[C@H]1C(=O)O)C(=O)CCC2=O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL11219671 0.83 LMNA (0.50) LMNACYP2C19HSD17B10
SCHEMBL11210570 0.83 LMNA (0.50) LMNACYP2C19HSD17B10
SCHEMBL11213089 0.81 ACE (0.43)
SCHEMBL11212426 0.80 ACE (0.31)
SCHEMBL11208686 0.78 LMNA (0.34) LMNACYP2C19HSD17B10
SCHEMBL11210192 0.77 ACE (0.38)
SCHEMBL11257080 0.76 ACE (0.37)
SCHEMBL11213000 0.76 ACE (0.50)
SCHEMBL11210160 0.76 ACE (0.37)
SCHEMBL11211954 0.75 ACE (0.35)

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
US-4311697-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1982-01-19 US disclosed