SCHEMBL328408

SCHEMBL328408

CN(CCN(CC(N)=O)S(=O)(=O)c1cc(F)c(Oc2ccc(F)cc2)c(F)c1)C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.35
MMP13 P45452 3/20 0.33
MMP1 P03956 2/20 0.33
MMP7 P09237 1/20 0.33
MMP8 P22894 1/20 0.33
MMP12 P39900 1/20 0.33
SLC9A3 P48764 4/20 0.33
KAT6A Q92794 1/20 0.32
KAT5 Q92993 1/20 0.32
TAS2R14 Q9NYV8 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
CACNA1H O95180 1/20 0.32
CACNA1B Q00975 1/20 0.32

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
SCHEMBL6863094 0.89 MMP13 (0.37) PDK2MMP13MMP1MMP7MMP8
SCHEMBL6864355 0.89 MMP13 (0.47) MMP13MMP1MMP7MMP8MMP12
SCHEMBL328416 0.88 SMN1; SMN2 (0.35) MMP13MMP1MMP7MMP8MMP12
SCHEMBL6852278 0.86 CACNA1H (0.40) MMP13MMP1MMP7MMP8MMP12
SCHEMBL328409 0.81 MMP1 (0.38) MMP13MMP1MMP7MMP8MMP12
SCHEMBL328403 0.80 MEN1 (0.40) ALDH1A1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL328473 0.77 F13A1 (0.41) CACNA1HPTPN1LMNA
SCHEMBL6863608 0.77 MMP1 (0.47) MMP13MMP1MMP7MMP8MMP12
SCHEMBL6852592 0.77 CHRM5 (0.35) MMP13MMP1MMP2MMP9KMT2A
SCHEMBL328414 0.76 DAGLA (0.37) MMP2MMP9ALDH1A1KMT2ASMN1; SMN2

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-1511488-B1 HUMAN ADAM-10 INHIBITORS SYMPHONY EVOLUTION INC (US) 2013-05-22 EP disclosed
EP-2428509-A1 Human adam-10 inhibitors Symphony Evolution, Inc. (US) 2012-03-14 EP disclosed
WO-2011011181-A1 PHARMACOLOGICAL CHAPERONES FOR THE TREATMENT OF ALZHEIMER'S DISEASE AMICUS THERAPEUTICS, INC. (US) 2011-01-27 WO disclosed