SCHEMBL5697803

SCHEMBL5697803

CCC(Cc1cccc2ccccc12)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.51
MME P08473 1/20 0.48
ACE P12821 1/20 0.48
CPA1 P15085 1/20 0.48
ACE2 Q9BYF1 1/20 0.48
MTNR1A P48039 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MMP9 P14780 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
PARP10 Q53GL7 1/20 0.43
HTR2A P28223 5/20 0.43
CYP3A4 P08684 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CHRM2 P08172 1/20 0.43
CHRM1 P11229 1/20 0.43
DRD1 P21728 1/20 0.43
SLC6A4 P31645 1/20 0.43
OPRM1 P35372 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
SCHEMBL8900559 0.90 MTNR1A (0.57) CTNNB1MTNR1ATDP1L3MBTL1MEN1
SCHEMBL3814684 0.86 CTNNB1 (0.56) CTNNB1MMEACECPA1ACE2
SCHEMBL5707319 0.85 MMP9 (0.52) CTNNB1MMEACECPA1ACE2
SCHEMBL1709345 0.84 CTNNB1 (0.51) CTNNB1MMEACECPA1ACE2
SCHEMBL1709287 0.84 CTNNB1 (0.51) CTNNB1MMEACECPA1ACE2
SCHEMBL13821722 0.82 MME (0.52) CTNNB1MMEACECPA1ACE2
SCHEMBL13575649 0.82 MME (0.52) CTNNB1MMEACECPA1ACE2
SCHEMBL13821887 0.82 EPHX2 (0.51) CTNNB1MEN1KMT2AHTR2ACYP3A4
SCHEMBL6677809 0.82 CTNNB1 (0.63) CTNNB1MMEACECPA1ACE2
SCHEMBL1284854 0.81 CTNNB1 (0.54) CTNNB1MMEACECPA1ACE2

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-1675824-A1 SOMATOSTATIN RECEPTOR 1 AND/OR 4 SELECTIVE AGONISTS AND ANTAGONISTS Oy Juvantia Pharma Ltd (FI) 2006-07-05 EP disclosed
WO-2005033069-A1 SOMATOSTATIN RECEPTOR 1 AND/OR 4 SELECTIVE AGONISTS AND ANTAGONISTS OY JUVANTIA PHARMA LTD (FI) 2005-04-14 WO disclosed