SCHEMBL5337143

SCHEMBL5337143

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP14 P50281 4/20 0.35
MMP8 P22894 3/20 0.35
MMP9 P14780 3/20 0.34
MMP13 P45452 3/20 0.34
MMP1 P03956 2/20 0.34
MMP3 P08254 2/20 0.34
SLC6A4 P31645 4/20 0.33
SLC6A3 Q01959 4/20 0.33
SLC6A2 P23975 1/20 0.33
GPR139 Q6DWJ6 1/20 0.32
HTR2C P28335 1/20 0.32
MCHR1 Q99705 1/20 0.32
EPHX2 P34913 4/20 0.32
MMP2 P08253 1/20 0.32
P2RY1 P47900 1/20 0.32
PDE2A O00408 1/20 0.32
HDAC1 Q13547 1/20 0.32
CCR6 P51684 2/20 0.32
HRH3 Q9Y5N1 1/20 0.32
KCNH2 Q12809 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
SCHEMBL5337131 0.71 SLC6A4 (0.34) MMP9MMP1MMP3SLC6A4SLC6A3
SCHEMBL5337780 0.70 MMP8 (0.41) MMP14MMP8MMP9MMP13MMP1
SCHEMBL27680758 0.68 SLC6A4 (0.37) SLC6A4SLC6A3SLC6A2EPHX2HRH3
SCHEMBL5474229 0.64 CTSS (0.37) SLC6A4SLC6A3SLC6A2EPHX2
SCHEMBL5412391 0.64 SLC6A4 (0.36) SLC6A4SLC6A3SLC6A2HTR2CEPHX2
SCHEMBL5449428 0.63 FPR2 (0.39) SLC6A4SLC6A3SLC6A2EPHX2HRH3
SCHEMBL5379847 0.61 MMP2 (0.41) MMP14MMP8MMP9MMP13MMP1
SCHEMBL28778792 0.59 SLC6A4 (0.46) SLC6A4SLC6A3SLC6A2HTR2CCCR6
SCHEMBL28955963 0.59 MMP2 (0.44) MMP8MMP9EPHX2MMP2HDAC1
SCHEMBL656498 0.58 SLC6A2 (0.38) SLC6A4SLC6A3SLC6A2HTR2CEPHX2

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