SCHEMBL5337780

SCHEMBL5337780

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 5/20 0.41
MMP2 P08253 5/20 0.41
MMP1 P03956 4/20 0.41
MMP14 P50281 3/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
ANPEP P15144 3/20 0.34
LTA4H P09960 2/20 0.34
CACNA1B Q00975 1/20 0.33
ADAM17 P78536 1/20 0.33
GPR139 Q6DWJ6 1/20 0.33
EPHX2 P34913 6/20 0.33
MMP9 P14780 4/20 0.33
MMP3 P08254 3/20 0.33
MMP13 P45452 2/20 0.33
LAP3 P28838 1/20 0.33
NPEPPS P55786 1/20 0.33
ERAP2 Q6P179 1/20 0.33
ERAP1 Q9NZ08 1/20 0.33

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
SCHEMBL5379847 0.92 MMP2 (0.41) MMP8MMP2MMP1MMP14ANPEP
SCHEMBL5450417 0.90 MMP2 (0.39) MMP8MMP2MMP1ANPEPLTA4H
SCHEMBL5345342 0.89 MMP2 (0.44) MMP8MMP2MMP1MMP14ANPEP
SCHEMBL5319634 0.88 MMP2 (0.43) MMP8MMP2MMP1ANPEPLTA4H
SCHEMBL5378455 0.88 MMP2 (0.42) MMP8MMP2MMP1SLC6A2SLC6A4
SCHEMBL5338202 0.87 CTSS (0.36) MMP2MMP1SLC6A2SLC6A4SLC6A3
SCHEMBL5323550 0.86 MMP2 (0.44) MMP8MMP2MMP1ANPEPLTA4H
SCHEMBL5462225 0.86 MMP2 (0.39) MMP8MMP2MMP1MMP14ANPEP
SCHEMBL5318825 0.86 MMP2 (0.42) MMP8MMP2MMP1ANPEPLTA4H
SCHEMBL5373840 0.85 MMP2 (0.37) MMP8MMP2MMP1MMP14ANPEP

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 2 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