SCHEMBL8912693

SCHEMBL8912693

CCC(N)COCC(=O)N(C)[C@H](Cc1ccc2ccccc2c1)C(=O)N(C)C(Cc1ccccc1)C(=O)NC

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 2/20 0.42
FCER2 P06734 2/20 0.41
TACR1 P25103 3/20 0.40
MME P08473 1/20 0.38
ACE P12821 1/20 0.38
CPA1 P15085 1/20 0.38
ACE2 Q9BYF1 1/20 0.38
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
MC4R P32245 4/20 0.36
MC3R P41968 4/20 0.36
MC5R P33032 2/20 0.36
KLKB1 P03952 1/20 0.36
MC1R Q01726 2/20 0.36

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
SCHEMBL6316964 1.00 GHSR (0.42) GHSRFCER2TACR1MMEACE
SCHEMBL6316746 0.94 MMP1 (0.41) GHSRFCER2TACR1MMP9MC4R
SCHEMBL6319166 0.90 PTPN1 (0.38) GHSRTACR1MMP9MMP8MC4R
SCHEMBL6319672 0.89 GHSR (0.44) GHSRTACR1MMP9MMP8KLKB1
SCHEMBL6320709 0.89 CYP1A2 (0.39) MMEACECPA1ACE2MMP9
SCHEMBL6324396 0.86 GHSR (0.46) GHSRFCER2TACR1MMP9MMP8
SCHEMBL6320145 0.85 TACR1 (0.39) TACR1MMP9MMP8KLKB1
SCHEMBL6324563 0.85 MMP3 (0.43) MMP9KLKB1
SCHEMBL6326078 0.84 S1PR1 (0.39) TACR1MMP9MMP8KLKB1
SCHEMBL6323403 0.84 CTSS (0.46) GHSRFCER2MMEACECPA1

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-1997023508-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1997-07-03 WO disclosed