SCHEMBL7889581

SCHEMBL7889581

CCN[C@H](Cc1ccc2ccccc2c1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MME P08473 7/20 0.62
ACE P12821 5/20 0.62
CPA1 P15085 2/20 0.62
ACE2 Q9BYF1 2/20 0.62
CA2 P00918 1/20 0.53
PIN1 Q13526 3/20 0.53
MMP9 P14780 2/20 0.51
MMP8 P22894 2/20 0.51
ALB P02768 1/20 0.48
IL2 P60568 1/20 0.48
CTSL P07711 1/20 0.48
CTSB P07858 1/20 0.48
CTSS P25774 1/20 0.48
CTSK P43235 1/20 0.48
TACR1 P25103 1/20 0.48
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
HTR2B P41595 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
SCHEMBL18435514 1.00 MME (0.62) MMEACECPA1ACE2CA2
SCHEMBL839945 1.00 MME (0.62) MMEACECPA1ACE2CA2
SCHEMBL12926815 0.88 MME (0.52) MMEACECPA1ACE2PIN1
SCHEMBL14374197 0.87 MME (0.51) MMEACECPA1ACE2PIN1
SCHEMBL13897059 0.87 MME (0.51) MMEACECPA1ACE2PIN1
SCHEMBL1097466 0.87 MME (0.57) MMEACECPA1ACE2CA2
SCHEMBL18435513 0.86 TACR1 (0.52) MMEACECPA1ACE2MMP9
SCHEMBL1060389 0.85 MME (0.56) MMEACECPA1ACE2CA2
SCHEMBL2888909 0.85 MME (0.56) MMEACECPA1ACE2CA2
SCHEMBL10071066 0.85 MME (0.61) MMEACECPA1ACE2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010107832-A1 LHRH-II PEPTIDE ANALOGS BRACCO IMAGING SPA (IT) 2010-09-23 WO disclosed