SCHEMBL5621032

SCHEMBL5621032

N#CN=C(N1CCOCC1)N1CCC(C(=O)N2CC[C@H](c3ccccc3)C2)C(C(=O)NO)C1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADAM10 O14672 15/20 0.53
ERBB2 P04626 13/20 0.53
MMP2 P08253 13/20 0.47
MMP8 P22894 1/20 0.45
MMP12 P39900 1/20 0.45
ADAM17 P78536 1/20 0.45
USP30 Q70CQ3 1/20 0.41
CTSS P25774 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
CTSB P07858 1/20 0.38
CTSK P43235 1/20 0.38

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
SCHEMBL2175309 1.00 ADAM10 (0.53) ADAM10ERBB2MMP2MMP8MMP12
SCHEMBL2175314 1.00 ADAM10 (0.53) ADAM10ERBB2MMP2MMP8MMP12
SCHEMBL2172019 0.93 ADAM10 (0.57) ADAM10ERBB2MMP2MMP8MMP12
SCHEMBL2172021 0.93 ADAM10 (0.57) ADAM10ERBB2MMP2MMP8MMP12
SCHEMBL5623049 0.93 ADAM10 (0.57) ADAM10ERBB2MMP2MMP8MMP12
SCHEMBL5623036 0.93 ADAM10 (0.57) ADAM10ERBB2MMP2MMP8MMP12
SCHEMBL2172174 0.93 ADAM10 (0.57) ADAM10ERBB2MMP2MMP8MMP12
SCHEMBL2172180 0.93 ADAM10 (0.57) ADAM10ERBB2MMP2MMP8MMP12
SCHEMBL5622904 0.92 ADAM10 (0.56) ADAM10ERBB2MMP2MMP8MMP12
SCHEMBL2172759 0.92 ADAM10 (0.56) ADAM10ERBB2MMP2MMP8MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007509075-A 2007-04-12 JP claimed
EP-1678167-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES Incyte Corporation (US) 2006-07-12 EP claimed
WO-2005037826-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES INCYTE CORPORATION (US) 2005-04-28 WO claimed
EP-1678167-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES Incyte Corporation (US) 2006-07-12 EP disclosed
WO-2005037826-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES INCYTE CORPORATION (US) 2005-04-28 WO disclosed