SCHEMBL5341776

SCHEMBL5341776

CC(C)C[C@H](C(=O)N1CCNC[C@@]1(C)c1ccc2c(c1)OCO2)[C@H](O)C(=O)NO

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.40
MMP2 P08253 2/20 0.40
MMP8 P22894 2/20 0.40
LMNA P02545 2/20 0.35
MAPT P10636 5/20 0.35
ALDH1A1 P00352 4/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 2/20 0.35
PKM P14618 1/20 0.35
BMP1 P13497 1/20 0.34
TAS1R3 Q7RTX0 2/20 0.34
TAS1R1 Q7RTX1 2/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LTA4H P09960 1/20 0.33
ANPEP P15144 1/20 0.33
SCN9A Q15858 1/20 0.33
MMP3 P08254 1/20 0.33
MMP7 P09237 1/20 0.33
CRHBP P24387 2/20 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
SCHEMBL5419543 0.90 ALDH1A1 (0.35) LMNAMAPTALDH1A1L3MBTL1KDM4E
SCHEMBL5379472 0.88 MMP1 (0.39) MMP1MMP2MMP8LTA4HANPEP
SCHEMBL5485913 0.87 MMP2 (0.38) MMP1MMP2MMP8TAS1R3TAS1R1
SCHEMBL5323550 0.84 MMP2 (0.44) MMP1MMP2MMP8LTA4HANPEP
SCHEMBL5319409 0.82 MMP2 (0.41) MMP1MMP2MMP8LTA4HANPEP
SCHEMBL5320062 0.82 MMP2 (0.43) MMP1MMP2MMP8LTA4HANPEP
SCHEMBL5403527 0.82 MMP2 (0.43) MMP1MMP2MMP8LTA4HANPEP
SCHEMBL5319634 0.82 MMP2 (0.43) MMP1MMP2MMP8MAPTALDH1A1
SCHEMBL5318825 0.81 MMP2 (0.42) MMP1MMP2MMP8LTA4HANPEP
SCHEMBL3868068 0.81 MMP2 (0.42) MMP1MMP2MMP8LTA4HANPEP

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