SCHEMBL5450417

SCHEMBL5450417

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

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.39
MMP1 P03956 6/20 0.39
MMP8 P22894 3/20 0.39
ADAM17 P78536 5/20 0.37
MMP9 P14780 7/20 0.34
ANPEP P15144 3/20 0.34
LTA4H P09960 2/20 0.34
LAP3 P28838 1/20 0.34
NPEPPS P55786 1/20 0.34
ERAP2 Q6P179 1/20 0.34
ERAP1 Q9NZ08 1/20 0.34
MMP3 P08254 2/20 0.33
MMP13 P45452 1/20 0.33
LIPE Q05469 2/20 0.33
MMP7 P09237 1/20 0.32
ACACB O00763 1/20 0.32

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
SCHEMBL5337780 0.90 MMP8 (0.41) MMP2MMP1MMP8ADAM17MMP9
SCHEMBL5378455 0.90 MMP2 (0.42) MMP2MMP1MMP8ADAM17MMP9
SCHEMBL5345342 0.90 MMP2 (0.44) MMP2MMP1MMP8ADAM17MMP9
SCHEMBL5379847 0.87 MMP2 (0.41) MMP2MMP1MMP8ADAM17MMP9
SCHEMBL5319634 0.87 MMP2 (0.43) MMP2MMP1MMP8ADAM17MMP9
SCHEMBL5323550 0.85 MMP2 (0.44) MMP2MMP1MMP8MMP9ANPEP
SCHEMBL5462225 0.85 MMP2 (0.39) MMP2MMP1MMP8ADAM17MMP9
SCHEMBL5323562 0.84 MMP2 (0.42) MMP2MMP1MMP8ADAM17MMP9
SCHEMBL5318825 0.84 MMP2 (0.42) MMP2MMP1MMP8ADAM17MMP9
SCHEMBL5403527 0.83 MMP2 (0.43) MMP2MMP1MMP8ADAM17MMP9

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