SCHEMBL8670844

SCHEMBL8670844

N#Cc1ccc(-c2ccccc2OCCCCC(=O)NO)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 4/20 0.69
HDAC1 Q13547 9/20 0.67
HDAC2 Q92769 8/20 0.67
MMP1 P03956 1/20 0.57
MMP2 P08253 1/20 0.57
MMP9 P14780 1/20 0.57
MMP13 P45452 1/20 0.57
HDAC6 Q9UBN7 5/20 0.54
HDAC3 O15379 4/20 0.54
HDAC4 P56524 4/20 0.54
HDAC7 Q8WUI4 4/20 0.54
HDAC10 Q969S8 4/20 0.54
HDAC11 Q96DB2 4/20 0.54
HDAC8 Q9BY41 4/20 0.54
HDAC9 Q9UKV0 4/20 0.54
HDAC5 Q9UQL6 4/20 0.54
PIM1 P11309 2/20 0.54
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.43

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
SCHEMBL7036402 0.86 HDAC2 (0.63) MMP3HDAC1HDAC2HDAC6HDAC3
SCHEMBL30179531 0.84 HDAC1 (0.66) HDAC1HDAC2HDAC6HDAC3HDAC4
SCHEMBL8939333 0.82 KDM4E (0.48) MMP3HDAC1HDAC2MMP2KDM4E
SCHEMBL6386979 0.82 MMP3 (1.00) MMP3HDAC1HDAC2MMP1MMP2
SCHEMBL8664028 0.82 LMNA (0.58) MMP3HDAC1HDAC2HDAC6HDAC3
SCHEMBL4741061 0.81 HDAC1 (1.00) MMP3HDAC1HDAC2MMP1MMP2
SCHEMBL6390923 0.81 HDAC1 (1.00) MMP3HDAC1HDAC2MMP1MMP2
SCHEMBL15522393 0.80 AR (0.51) MMP3HDAC1HDAC2KDM4EALDH1A1
SCHEMBL9206767 0.78 KDM4E (0.49) KDM4EALDH1A1
SCHEMBL7046816 0.78 MMP3 (0.92) MMP3HDAC1HDAC2MMP1MMP2

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-0874808-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 1998-11-04 EP disclosed
WO-1997018188-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1997-05-22 WO disclosed