SCHEMBL8905430

SCHEMBL8905430

CNC(=O)C(Cc1ccccc1)NC(=O)C(NC)C(C)c1ccc2ccccc2c1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FCER2 P06734 4/20 0.56
MMP2 P08253 6/20 0.50
MMP9 P14780 5/20 0.50
MMP8 P22894 5/20 0.50
MMP1 P03956 9/20 0.49
MMP3 P08254 5/20 0.48
MMP7 P09237 2/20 0.47
PLAT P00750 1/20 0.46
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A4 P31645 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KCNH2 Q12809 1/20 0.45
MME P08473 1/20 0.45
ACE P12821 1/20 0.45
CPA1 P15085 1/20 0.45
ACE2 Q9BYF1 1/20 0.45

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
SCHEMBL8914696 0.92 FCER2 (0.50) FCER2MMP2MMP9MMP8MMP1
SCHEMBL8235027 0.87 MMP9 (0.43) FCER2MMP9MMP8CYP3A4CYP2D6
SCHEMBL8914878 0.87 HTRA1 (0.46) FCER2MMP2MMP9MMP8SLC6A2
SCHEMBL7132131 0.86 MMP2 (0.54) FCER2MMP2MMP9MMP8MMP1
SCHEMBL8906164 0.81 CYP1A2 (0.49) CYP3A4CYP2D6
SCHEMBL7771306 0.79 CA2 (0.45) CYP2D6
SCHEMBL20160263 0.75 MMP1 (0.61) FCER2MMP2MMP9MMP8MMP1
SCHEMBL25139614 0.75 MMP1 (0.64) FCER2MMP2MMP9MMP8MMP1
SCHEMBL13884333 0.75 MMP1 (0.64) FCER2MMP2MMP9MMP8MMP1
SCHEMBL22962378 0.75 MMP1 (0.64) FCER2MMP2MMP9MMP8MMP1

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