SCHEMBL7047874

SCHEMBL7047874

N#Cc1ccc(-c2cccc(OCCCC(=O)NOCc3ccccc3)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP3 P08254 3/20 0.50
▸ FFAR4 Q5NUL3 4/20 0.49
▸ HDAC1 Q13547 4/20 0.49
▸ HDAC2 Q92769 4/20 0.49
▸ FFAR1 O14842 2/20 0.49
▸ MMP2 P08253 2/20 0.46
▸ MMP1 P03956 1/20 0.46
▸ MMP9 P14780 1/20 0.46
▸ MMP13 P45452 1/20 0.46
▸ ABCB1 P08183 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ ABCG2 Q9UNQ0 1/20 0.46
▸ SMPD1 P17405 2/20 0.45
▸ GPR34 Q9UPC5 1/20 0.44
▸ HDAC8 Q9BY41 2/20 0.44
▸ HDAC6 Q9UBN7 2/20 0.44
▸ HDAC3 O15379 1/20 0.44
▸ HDAC4 P56524 1/20 0.44
▸ HDAC7 Q8WUI4 1/20 0.44
▸ HDAC10 Q969S8 1/20 0.44

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
SCHEMBL7045221 0.86 MRGPRX4 (0.55) FFAR4HDAC1HDAC2FFAR1HPGD
SCHEMBL7043153 0.82 MMP3 (0.73) MMP3FFAR4HDAC1HDAC2FFAR1
SCHEMBL7046517 0.82 ABCB1 (0.52) MMP3HDAC1HDAC2FFAR1MMP13
SCHEMBL7048536 0.79 MMP3 (0.79) MMP3HDAC1HDAC2MMP2MMP1
SCHEMBL7044314 0.78 HDAC3 (0.49) HDAC1HDAC2HPGDSMPD1HDAC8
SCHEMBL7047538 0.74 MMP3 (0.60) MMP3HDAC1HDAC2MMP2MMP1
SCHEMBL17231860 0.74 CYP11B1 (0.53) MMP3FFAR4HDAC1HDAC2FFAR1
SCHEMBL7047498 0.73 HDAC1 (0.68) MMP3FFAR4HDAC1HDAC2FFAR1
SCHEMBL15810332 0.73 HDAC1 (0.55) MMP3FFAR4HDAC1HDAC2FFAR1
SCHEMBL7042844 0.72 HDAC2 (0.58) HDAC1HDAC2FFAR1HDAC8HDAC6

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-B1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LAB (US) 2003-04-09 — — EP disclosed
US-5665777-A ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1997-09-09 — — US disclosed
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