SCHEMBL3457344

SCHEMBL3457344

Cc1ccc(OC2CC[C@H](C(=O)N3CCN(c4ccccc4)CC3)[C@@H](C(=O)NO)C2)cn1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADAM10 O14672 20/20 0.58
ERBB2 P04626 20/20 0.58
MMP2 P08253 18/20 0.58
MMP9 P14780 11/20 0.54
MMP3 P08254 6/20 0.52

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
SCHEMBL2176740 1.00 ADAM10 (0.58) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL3457348 1.00 ADAM10 (0.58) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL28762373 0.89 ADAM10 (0.61) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2173269 0.89 ADAM10 (0.61) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2175009 0.88 ADAM10 (0.67) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2174818 0.88 ADAM10 (0.59) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL5638616 0.88 ADAM10 (0.59) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL3457380 0.86 ADAM10 (0.62) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2172461 0.86 ADAM10 (0.62) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL3457377 0.86 ADAM10 (0.62) ADAM10ERBB2MMP2MMP9MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2264030-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases Incyte Corporation (US) 2010-12-22 EP claimed