SCHEMBL11545180

SCHEMBL11545180

CCOC(=O)SCCC(=O)OC(=O)[C@@H]1CCCN1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRCP P42785 2/20 0.34
DPP4 P27487 4/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP7 Q9UHL4 1/20 0.31
SLC6A2 P23975 3/20 0.30
SLC6A3 Q01959 3/20 0.30
SLC6A4 P31645 2/20 0.30
SCN4A P35499 1/20 0.30
THRB P10828 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
TLR2 O60603 1/20 0.30

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
SCHEMBL11546808 0.88 ALDH1A1 (0.36) PRCPDPP4DPP8DPP7
SCHEMBL7376051 0.84 PRCP (0.34) PRCPDPP4DPP8DPP7SCN4A
SCHEMBL11618241 0.84 PRCP (0.38) PRCPDPP4DPP8DPP7SLC6A2
SCHEMBL11549357 0.81 PRCP (0.39) PRCPDPP4DPP7TLR2
SCHEMBL11549946 0.81 PRCP (0.33) PRCPDPP7
SCHEMBL11546116 0.81 MEN1 (0.39) PRCPDPP4DPP8DPP7SCN4A
SCHEMBL23039193 0.79 PRCP (0.35) PRCPDPP4DPP8DPP7SLC6A2
SCHEMBL599792 0.79 ALDH1A1 (0.45) PRCPDPP4DPP8DPP7SCN4A
SCHEMBL542283 0.79 NOS2 (0.39) PRCPDPP4DPP8DPP7SCN4A
SCHEMBL11545563 0.79 PRCP (0.33) PRCPDPP7

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