SCHEMBL7380818

SCHEMBL7380818

CC(=O)SC(C)CC(=O)OC(=O)[C@@H]1CCCN1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRCP P42785 1/20 0.33
DPP7 Q9UHL4 1/20 0.32
TLR2 O60603 2/20 0.31
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 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
SCHEMBL11546266 0.85 PRCP (0.33) PRCPDPP7TLR2MEN1KMT2A
SCHEMBL11378883 0.84 PRCP (0.34) PRCPDPP7TLR2
SCHEMBL11449185 0.82 HTR2C (0.32) PRCPDPP7MEN1KMT2ACYP1A2
SCHEMBL7380845 0.80 PRCP (0.35) PRCPDPP7TLR2CYP1A2CYP3A4
SCHEMBL11546726 0.79 GHSR (0.38) TSHRCYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL11372885 0.78 PRCP (0.31) PRCPDPP7TLR2CYP1A2CYP3A4
SCHEMBL11558601 0.78 PRCP (0.34) PRCPDPP7TLR2MEN1KMT2A
SCHEMBL11158897 0.77 CYP1A2 (0.37) CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL11464278 0.76 CYP3A4 (0.37) TSHRMEN1KMT2ACYP1A2CYP3A4
SCHEMBL30265157 0.76 PRCP (0.44) PRCPDPP7TLR2

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 3 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
US-4046889-A HYPOTENSIVE AGENTS, ENZYME INHIBITORS, ANGIOTENSIN CONVERSION E. R. SQUIBB & SONS, INC. (US) 1977-09-06 US disclosed