SCHEMBL6024643

SCHEMBL6024643

N#CN=C(Oc1ccccc1)N1CCC(C(=O)N2CC[C@H](c3ccccc3)C2)C(C(=O)O)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.41
ADAM10 O14672 2/20 0.40
ERBB2 P04626 1/20 0.40
RAB9A P51151 8/20 0.40
ALDH1A1 P00352 5/20 0.40
SMN1; SMN2 Q16637 5/20 0.40
NPC1 O15118 5/20 0.40
TP53 P04637 2/20 0.40
PARP14 Q460N5 1/20 0.40
PARP10 Q53GL7 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 6/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL3457479 1.00 USP30 (0.41) USP30ADAM10ERBB2RAB9AALDH1A1
SCHEMBL3457481 1.00 USP30 (0.41) USP30ADAM10ERBB2RAB9AALDH1A1
SCHEMBL2174428 0.91 ADAM10 (0.42) USP30ADAM10ERBB2RAB9AALDH1A1
SCHEMBL2174431 0.83 ADAM10 (0.41) USP30ADAM10ERBB2RAB9AALDH1A1
SCHEMBL6024319 0.77 POLB (0.37) ADAM10ALDH1A1POLBKMT2AHTT
SCHEMBL3456956 0.77 POLB (0.37) ADAM10ALDH1A1POLBKMT2AHTT
SCHEMBL3456952 0.77 POLB (0.37) ADAM10ALDH1A1POLBKMT2AHTT
SCHEMBL2171983 0.76 ADAM10 (0.44) USP30ADAM10ERBB2RAB9AALDH1A1
SCHEMBL6023763 0.76 ADAM10 (0.44) USP30ADAM10ERBB2RAB9AALDH1A1
SCHEMBL5622655 0.75 ADAM10 (0.55) USP30ADAM10ERBB2RAB9AALDH1A1

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-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