SCHEMBL7047739

SCHEMBL7047739

N#Cc1ccc(-c2ccc(CCCC(=O)NO)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP3 P08254 2/20 0.66
▸ HDAC1 Q13547 11/20 0.64
▸ HDAC2 Q92769 8/20 0.64
▸ MMP13 P45452 2/20 0.61
▸ MMP1 P03956 1/20 0.61
▸ MMP2 P08253 1/20 0.61
▸ MMP9 P14780 1/20 0.61
▸ HDAC6 Q9UBN7 5/20 0.57
▸ HDAC8 Q9BY41 4/20 0.57
▸ HDAC3 O15379 3/20 0.57
▸ HDAC5 Q9UQL6 3/20 0.57
▸ HDAC4 P56524 2/20 0.53
▸ HDAC7 Q8WUI4 2/20 0.53
▸ HDAC10 Q969S8 2/20 0.53
▸ HDAC11 Q96DB2 2/20 0.53
▸ HDAC9 Q9UKV0 2/20 0.53
▸ TSHR P16473 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ ALOX5 P09917 1/20 0.50
▸ MMP12 P39900 1/20 0.49

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
SCHEMBL7043051 0.81 HDAC2 (0.90) HDAC1HDAC2HDAC6HDAC8HDAC3
SCHEMBL7046816 0.81 MMP3 (0.92) MMP3HDAC1HDAC2MMP13MMP1
SCHEMBL6386979 0.79 MMP3 (1.00) MMP3HDAC1HDAC2MMP13MMP1
SCHEMBL6390923 0.78 HDAC1 (1.00) MMP3HDAC1HDAC2MMP13MMP1
SCHEMBL4741061 0.78 HDAC1 (1.00) MMP3HDAC1HDAC2MMP13MMP1
SCHEMBL17857810 0.78 TSHR (0.72) MMP3MMP13TSHRHSD17B10MMP12
SCHEMBL7046517 0.78 ABCB1 (0.52) MMP3HDAC1HDAC2MMP13HDAC6
SCHEMBL6138535 0.77 MMP3 (0.64) MMP3HDAC1HDAC2MMP13MMP1
SCHEMBL6138747 0.77 MMP3 (0.64) MMP3HDAC1HDAC2MMP13MMP1
SCHEMBL1336456 0.77 FFAR1 (0.67) HDAC1HDAC2MMP13MMP2HDAC6

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874808-B1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LAB (US) 2003-04-09 — — EP claimed
EP-0874808-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 1998-11-04 — — EP claimed
WO-1997018188-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1997-05-22 — — WO claimed
EP-0874808-B1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LAB (US) 2003-04-09 — — EP disclosed
EP-0874808-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 1998-11-04 — — EP disclosed
US-5665777-A ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1997-09-09 — — US disclosed
WO-1997018188-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1997-05-22 — — WO disclosed
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