SCHEMBL7634952

SCHEMBL7634952

O=C(O)CNC(=O)c1ccc(CCC(CC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)C(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.48
MMP3 P08254 4/20 0.48
MMP9 P14780 3/20 0.48
MMP13 P45452 2/20 0.48
MMP1 P03956 1/20 0.48
MMP8 P22894 1/20 0.48
MCHR1 Q99705 5/20 0.48
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
EPHX2 P34913 1/20 0.46
PPARG P37231 1/20 0.46
EGLN1 Q9GZT9 2/20 0.44
CYP2D6 P10635 2/20 0.44
CHRM1 P11229 2/20 0.44
HTR2A P28223 2/20 0.44
CYP2C19 P33261 2/20 0.43
NPC1 O15118 1/20 0.43
CYP1A2 P05177 1/20 0.43
GAA P10253 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
SCHEMBL7627770 0.87 MCHR1 (0.58) MMP2MMP3MMP9MMP13MMP1
SCHEMBL7625129 0.87 MEN1 (0.54) MMP2MMP3MMP9MMP13MMP1
SCHEMBL7634674 0.86 SMN1; SMN2 (0.55) MMP2MMP3MMP9MMP13MMP1
SCHEMBL7630081 0.85 MMP2 (0.50) MMP2MMP3MMP9MMP13MMP1
SCHEMBL7625075 0.79 MCHR1 (0.51) MMP2MMP3MMP9MMP13MMP1
SCHEMBL7633774 0.79 GCG (0.46) MMP2MMP3MMP9MMP13MMP1
SCHEMBL7632375 0.78 NPC1 (0.53) MMP2MMP3MMP9MMP13MMP1
SCHEMBL7623455 0.78 F10 (0.53) MMP2MMP3MMP9MMP13MMP1
SCHEMBL7633124 0.77 LMNA (0.50) MMP2MMP3MMP9MMP13MMP1
SCHEMBL13752658 0.77 KMT2A (0.54) MMP2MMP3MMP9MMP13MMP1

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-0907632-B1 INHIBITION OF MATRIX METALLOPROTEASES BY SUBSTITUTED PHENETHYL COMPOUNDS BAYER AG (US) 2002-12-11 EP disclosed