SCHEMBL3274946

SCHEMBL3274946

CN[C@H](Cc1ccc2ccccc2c1)C(=O)N(C)[C@H](Cc1ccccc1)C(=O)NN1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
FCER2 P06734 2/20 0.42
F2 P00734 1/20 0.42
GHSR Q92847 2/20 0.42
TACR1 P25103 8/20 0.40
CAPN1 P07384 1/20 0.40
MME P08473 1/20 0.40
ACE P12821 1/20 0.40
CPA1 P15085 1/20 0.40
ACE2 Q9BYF1 1/20 0.40

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
SCHEMBL3274925 0.99 MMP9 (0.45) MMP9MMP8FCER2F2GHSR
SCHEMBL3270650 0.89 ALDH1A1 (0.41) MMP9MMP8F2MMEACE
SCHEMBL3266781 0.88 ALDH1A1 (0.42) MMP9MMP8F2MMEACE
SCHEMBL3268068 0.86 GHSR (0.44) MMP9MMP8FCER2F2GHSR
SCHEMBL4426088 0.85 FCER2 (0.53) MMP9MMP8FCER2F2GHSR
SCHEMBL4427112 0.85 FCER2 (0.53) MMP9MMP8FCER2F2GHSR
SCHEMBL6317992 0.85 FCER2 (0.53) MMP9MMP8FCER2F2GHSR
SCHEMBL6316765 0.84 BDKRB2 (0.45) MMP9MMP8FCER2F2GHSR
SCHEMBL3266812 0.83 MMP9 (0.47) MMP9MMP8FCER2F2GHSR
SCHEMBL6324655 0.82 MME (0.47) MMP9MMP8FCER2F2GHSR

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
EP-1506969-B1 Compounds with growth hormone releasing properties HELSINN THERAPEUTICS US INC (US) 2010-06-09 EP claimed