SCHEMBL5039619

SCHEMBL5039619

Cc1cc(C)cc(C2=CCNC(C(=O)C3NCC4(CC4)CC3C(=O)NO)C2)c1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADAM10 O14672 20/20 0.61
MMP2 P08253 16/20 0.61
MMP9 P14780 10/20 0.51
MMP3 P08254 5/20 0.51
MMP1 P03956 3/20 0.51
ERBB2 P04626 7/20 0.47

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
SCHEMBL5044734 1.00 ADAM10 (0.61) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL5042911 0.91 ADAM10 (0.63) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL5044852 0.88 ADAM10 (0.61) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL5038844 0.88 ADAM10 (0.60) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL5035337 0.88 ADAM10 (0.48) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL5038686 0.87 ADAM10 (0.63) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL5038505 0.87 ADAM10 (0.63) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL6023831 0.86 ADAM10 (0.61) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL5042806 0.86 ADAM10 (0.47) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL5038217 0.85 ADAM10 (0.47) ADAM10MMP2MMP9MMP3MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1622569-A4 AZA SPIRO ALKANE DERIVATIVES AS INHIBITORS OF METALLPROTEASES INCYTE CORP (US) 2008-08-27 EP disclosed
EP-1622569-A2 AZA SPIRO ALKANE DERIVATIVES AS INHIBITORS OF METALLPROTEASES Incyte Corporation (US) 2006-02-08 EP disclosed
WO-2004096139-A2 AZA SPIRO ALKANE DERIVATIVES AS INHIBITORS OF METALLOPROTEASES INCYTE CORPORATION (US) 2004-11-11 WO disclosed