SCHEMBL7174366

SCHEMBL7174366

OCCOc1cccc(C=NO)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FURIN P09958 1/20 0.54
ALDH1A1 P00352 3/20 0.48
RECQL P46063 1/20 0.48
NPC1 O15118 6/20 0.47
RAB9A P51151 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
POLB P06746 2/20 0.47
MAPK1 P28482 2/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CHRM5 P08912 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 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
SCHEMBL7174364 1.00 FURIN (0.54) FURINALDH1A1RECQLNPC1RAB9A
SCHEMBL16958059 0.81 ALDH1A1 (0.53) FURINALDH1A1RECQLNPC1RAB9A
SCHEMBL4764468 0.79 ALDH1A1 (0.52) FURINALDH1A1RECQLNPC1RAB9A
SCHEMBL6881704 0.79 ALDH1A1 (0.52) FURINALDH1A1RECQLNPC1RAB9A
SCHEMBL377789 0.79 MAOA (0.58) FURINALDH1A1RECQLNPC1RAB9A
SCHEMBL29898196 0.79 MAOA (0.58) FURINALDH1A1RECQLNPC1RAB9A
SCHEMBL13310217 0.79 FURIN (0.50) FURINALDH1A1RECQLNPC1RAB9A
SCHEMBL14648612 0.79 KMT2A (0.71) ALDH1A1RECQLNPC1RAB9ASMN1; SMN2
SCHEMBL13310213 0.78 FURIN (0.46) FURINALDH1A1RECQLNPC1RAB9A
SCHEMBL48418 0.78 ALDH1A1 (0.70) ALDH1A1RECQLMAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6652970-B1 Stable after transformation 3M INNOVATIVE PROPERTIES COMPANY 2003-11-25 US disclosed
EP-1301470-A1 DEGRADABLE CROSSLINKERS, COMPOSITIONS THEREFROM, AND METHODS OF THEIR PREPARATION AND USE 3M Innovative Properties Company (US) 2003-04-16 EP disclosed
WO-2002004408-A1 DEGRADABLE CROSSLINKERS, COMPOSITIONS THEREFROM, AND METHODS OF THEIR PREPARATION AND USE 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-01-17 WO disclosed
WO-2002004548-A1 POLYMER COMPOSITIONS WITH ENERGETICALLY DEGRADABLE CROSSLINKER 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-01-17 WO disclosed