SCHEMBL7273085

SCHEMBL7273085

CCCN(CCC)C(=O)N(C)CCN(C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.52
CA1 P00915 2/20 0.52
CA9 Q16790 2/20 0.52
LMNA P02545 1/20 0.47
MME P08473 5/20 0.46
ACE P12821 2/20 0.46
CPA1 P15085 1/20 0.45
ACE2 Q9BYF1 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
LPAR1 Q92633 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
FPR2 P25090 3/20 0.43
PTPN1 P18031 1/20 0.43
PSMB1 P20618 1/20 0.43
PSMB5 P28074 1/20 0.43
PSMB2 P49721 1/20 0.43
NAALAD2 Q9Y3Q0 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL7273716 0.88 TACR1 (0.47) ACE
SCHEMBL6895655 0.82 ITGA4 (0.54) CA12CA1CA9LMNAMME
SCHEMBL7271561 0.81 ACE (0.50) CA12CA1CA9LMNAMME
SCHEMBL7272209 0.77 MME (0.57) CA12CA1CA9LMNAMME
SCHEMBL16195620 0.77 MME (0.58) LMNAMMEACECPA1ACE2
SCHEMBL27541800 0.77 L3MBTL1 (0.46) CA12CA1CA9LMNAMME
SCHEMBL6891310 0.77 L3MBTL1 (0.46) CA12CA1CA9LMNAMME
SCHEMBL7283853 0.76 ALDH1A1 (0.53) LMNAMMEFPR2PSMB1PSMB5
SCHEMBL7282932 0.76 ALDH1A1 (0.53) LMNAMMEFPR2PSMB1PSMB5
SCHEMBL9068639 0.76 ALDH1A1 (0.53) LMNAMMEFPR2PSMB1PSMB5

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-5491132-A HYPOTENSIVE AGENT FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-02-13 US disclosed
EP-0476515-A1 New amino acid derivatives, a process for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-03-25 EP disclosed