SCHEMBL11547486

SCHEMBL11547486

Cc1ccc(SSC(C)CC(=O)N2CCC[C@H]2C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.44
REN P00797 1/20 0.44
DPP4 P27487 2/20 0.44
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL11544932 0.79 ACE (0.46) ACERENDPP4SMN1; SMN2
SCHEMBL7380820 0.74 ACE (0.54) ACEREN
Water SCHEMBL5570208 0.73 ACE (0.52) ACEREN
SCHEMBL15854285 0.73 ACE (0.62) ACEREN
SCHEMBL5742535 0.73 ACE (0.62) ACEREN
SCHEMBL5742529 0.73 ACE (0.62) ACEREN
SCHEMBL11548591 0.72 ALDH1A1 (0.57) ACESMN1; SMN2
SCHEMBL9501764 0.72 ACE (0.55) ACERENPOLBSMN1; SMN2
SCHEMBL21246658 0.72 ACE (0.60) ACEREN
SCHEMBL21246655 0.72 ACE (0.60) ACEREN

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-4154840-A Antihypertensive pipecolic acid derivatives E. R. SQUIBB & SONS, INC. (US) 1979-05-15 US disclosed
US-4105776-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS, HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1978-08-08 US disclosed