SCHEMBL7356129

SCHEMBL7356129

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

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MME P08473 10/20 0.52
ACE P12821 5/20 0.52
NPSR1 Q6W5P4 1/20 0.51
LMNA P02545 1/20 0.51
ACE2 Q9BYF1 3/20 0.49
CPA1 P15085 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
LPAR1 Q92633 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA9 Q16790 1/20 0.47
PTPN1 P18031 1/20 0.47
NAALAD2 Q9Y3Q0 1/20 0.47

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
SCHEMBL7272209 0.90 MME (0.57) MMEACENPSR1LMNAACE2
SCHEMBL14398153 0.81 MME (0.49) MMEACENPSR1LMNAACE2
SCHEMBL9554565 0.80 PTPN1 (0.61) MMEACENPSR1ACE2CPA1
SCHEMBL16195620 0.78 MME (0.58) MMEACENPSR1LMNAACE2
SCHEMBL7266724 0.76 MEN1 (0.60) ACE
SCHEMBL7275396 0.76 MME (0.56) MMEACENPSR1LMNAACE2
SCHEMBL7278010 0.76 MME (0.56) MMEACENPSR1LMNAACE2
SCHEMBL7356137 0.74 MME (0.51) MMEACENPSR1LMNAACE2
SCHEMBL19974071 0.74 L3MBTL1 (0.60) MMEACENPSR1LMNAACE2
SCHEMBL9554773 0.74 PTPN1 (0.57) MMEACENPSR1ACE2CPA1

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
EP-0644892-A1 INHIBITORS OF ANGIOTENSIN I CHYMASE(S) INCLUDING HUMAN HEART CHYMASE PFIZER INC. (US) 1995-03-29 EP disclosed
WO-1993025574-A1 INHIBITORS OF ANGIOTENSIN I CHYMASE(S) INCLUDING HUMAN HEART CHYMASE PFIZER INC. (US) 1993-12-23 WO disclosed