SCHEMBL5318800

SCHEMBL5318800

CC(C)C[C@H](C(=O)N1CCNC[C@@]1(C)c1ccc(C2CCCCC2)cc1)[C@H](O)C(=O)NO

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 6/20 0.44
MMP1 P03956 6/20 0.44
MMP8 P22894 4/20 0.44
MMP3 P08254 5/20 0.44
MMP7 P09237 1/20 0.44
ANPEP P15144 3/20 0.38
MMP9 P14780 3/20 0.38
LTA4H P09960 2/20 0.38
LAP3 P28838 1/20 0.38
NPEPPS P55786 1/20 0.38
ERAP2 Q6P179 1/20 0.38
ERAP1 Q9NZ08 1/20 0.38
MMP13 P45452 2/20 0.33
APP P05067 1/20 0.33
CCR1 P32246 1/20 0.31

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
SCHEMBL5319325 0.90 CCR1 (0.34) MMP2MMP1MMP8MMP3MMP7
SCHEMBL5323550 0.86 MMP2 (0.44) MMP2MMP1MMP8MMP3MMP7
SCHEMBL5403527 0.84 MMP2 (0.43) MMP2MMP1MMP8MMP3MMP7
SCHEMBL5319634 0.84 MMP2 (0.43) MMP2MMP1MMP8MMP3MMP7
SCHEMBL5320062 0.84 MMP2 (0.43) MMP2MMP1MMP8MMP3MMP7
SCHEMBL5378455 0.83 MMP2 (0.42) MMP2MMP1MMP8MMP3MMP7
SCHEMBL3868068 0.83 MMP2 (0.42) MMP2MMP1MMP8MMP3MMP7
SCHEMBL5345342 0.83 MMP2 (0.44) MMP2MMP1MMP8MMP3MMP7
SCHEMBL5318825 0.83 MMP2 (0.42) MMP2MMP1MMP8MMP3MMP7
SCHEMBL5379847 0.82 MMP2 (0.41) MMP2MMP1MMP8MMP3MMP7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1771421-A1 N-HYDROXYAMIDE DERIVATIVES AND USE THEREOF Applied Research Systems ARS Holding N.V. (AN) 2007-04-11 EP claimed
WO-2006010751-A1 N-HYDROXYAMIDE DERIVATIVES AND USE THEREOF APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2006-02-02 WO claimed
EP-1771421-A1 N-HYDROXYAMIDE DERIVATIVES AND USE THEREOF Applied Research Systems ARS Holding N.V. (AN) 2007-04-11 EP disclosed
WO-2006010751-A1 N-HYDROXYAMIDE DERIVATIVES AND USE THEREOF APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2006-02-02 WO disclosed