SCHEMBL10046336

SCHEMBL10046336

CC(C)(C)OC(=O)NCCC(=O)N1CCSSCC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.53
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
HDAC8 Q9BY41 1/20 0.41
GAA P10253 1/20 0.41
EPHX1 P07099 1/20 0.40
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
PREP P48147 1/20 0.38
DRD2 P14416 2/20 0.38
NR2F2 P24468 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CTSD P07339 1/20 0.37
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
CTSS P25774 1/20 0.37

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
SCHEMBL13861254 0.86 SIGMAR1 (0.56) SIGMAR1MEN1KMT2AALDH1A1TSHR
SCHEMBL19199734 0.85 SIGMAR1 (0.55) SIGMAR1MEN1KMT2AALDH1A1TSHR
SCHEMBL4180217 0.84 SIGMAR1 (0.57) SIGMAR1MEN1KMT2AALDH1A1TSHR
SCHEMBL1328433 0.82 CTSD (0.54) SIGMAR1MEN1KMT2AALDH1A1TSHR
SCHEMBL2429327 0.82 SIGMAR1 (0.56) SIGMAR1MEN1KMT2AALDH1A1TSHR
SCHEMBL4434497 0.82 SIGMAR1 (0.53) SIGMAR1MEN1KMT2AALDH1A1TSHR
SCHEMBL13799649 0.80 SIGMAR1 (0.65) SIGMAR1MEN1KMT2AALDH1A1TSHR
SCHEMBL28329410 0.80 SIGMAR1 (0.51) SIGMAR1MEN1KMT2AALDH1A1TSHR
SCHEMBL30859928 0.79 SIGMAR1 (0.53) SIGMAR1MEN1KMT2AALDH1A1TSHR
SCHEMBL13951311 0.78 SIGMAR1 (0.49) SIGMAR1MEN1KMT2AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2630494-B1 METHOD FOR FUNCTIONALISING SURFACES FOR ANALYTE DETECTION CENTRE NAT RECH SCIENT (FR) 2020-03-18 EP disclosed
US-9671397-B2 Method for functionalizing surfaces for analyte detection CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2017-06-06 US disclosed
US-9671397-B2 Method for functionalizing surfaces for analyte detection CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2017-06-06 US disclosed
US-20130203629-A1 METHOD FOR FUNCTIONALIZING SURFACES FOR ANALYTE DETECTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-08-08 US disclosed
US-20130203629-A1 METHOD FOR FUNCTIONALIZING SURFACES FOR ANALYTE DETECTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-08-08 US disclosed
WO-2012052874-A1 METHOD FOR FUNCTIONALISING SURFACES FOR ANALYTE DETECTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-04-26 WO disclosed