SCHEMBL7302308

SCHEMBL7302308

CCCC[C@H](C(=O)OCC)N1CCNC[C@@H]1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 5/20 0.44
SLC6A3 Q01959 5/20 0.44
SLC6A2 P23975 4/20 0.44
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA4 P22748 2/20 0.41
CA9 Q16790 2/20 0.41
DPP4 P27487 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
DPP7 Q9UHL4 2/20 0.39
REN P00797 1/20 0.38

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
SCHEMBL7475303 0.77 CA1 (0.56) SLC6A4SLC6A3SLC6A2CA1CA2
SCHEMBL7303601 0.77 CA1 (0.41) SLC6A4SLC6A3SLC6A2CA1CA2
SCHEMBL7302302 0.77 CA1 (0.41) SLC6A4SLC6A3SLC6A2CA1CA2
SCHEMBL7302310 0.77 CA1 (0.41) SLC6A4SLC6A3SLC6A2CA1CA2
SCHEMBL4658657 0.73 SLC6A4 (0.50) SLC6A4SLC6A3SLC6A2CA1CA2
SCHEMBL28597945 0.72 CA1 (0.46) SLC6A4SLC6A3SLC6A2CA1CA2
SCHEMBL4657002 0.72 SLC6A4 (0.49) SLC6A4SLC6A3SLC6A2CA1CA2
SCHEMBL9311330 0.70 SLC6A4 (0.52) SLC6A4SLC6A3SLC6A2L3MBTL1
SCHEMBL9309772 0.69 SLC6A4 (0.50) SLC6A4SLC6A3SLC6A2L3MBTL1
SCHEMBL8654796 0.69 MITF (0.57) SLC6A4SLC6A3SLC6A2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5164388-A Hypotensive agents, treatment of congestive heart failure ABBOTT LABORATORIES (US) 1992-11-17 US disclosed
EP-0439556-A1 HETEROCYCLIC PEPTIDE RENIN INHIBITORS ABBOTT LABORATORIES (US) 1991-08-07 EP disclosed
WO-1990004917-A1 HETEROCYCLIC PEPTIDE RENIN INHIBITORS ABBOTT LABORATORIES (US) 1990-05-17 WO disclosed
EP-0365992-A1 Heterocyclic peptide renin inhibitors ABBOTT LABORATORIES (US) 1990-05-02 EP disclosed