SCHEMBL19354545

SCHEMBL19354545

Cc1cccc(C(=O)OCCOCCN2CCOCC2)c1

nearest known ligand 0.84

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.84
KDM4E B2RXH2 3/20 0.55
GAA P10253 2/20 0.55
PKM P14618 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
ATM Q13315 1/20 0.54
TSHR P16473 1/20 0.49
ALDH1A1 P00352 2/20 0.48
HPGD P15428 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
LMNA P02545 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL10084675 0.93 L3MBTL1 (0.97) L3MBTL1KDM4EGAAPKMSMN1; SMN2
SCHEMBL19354714 0.88 L3MBTL1 (0.80) L3MBTL1KDM4EGAAPKMSMN1; SMN2
SCHEMBL19321948 0.85 L3MBTL1 (0.61) L3MBTL1KDM4EGAAPKMSMN1; SMN2
SCHEMBL11985694 0.82 L3MBTL1 (0.57) L3MBTL1KDM4EPKMSMN1; SMN2TSHR
SCHEMBL29735083 0.82 L3MBTL1 (0.57) L3MBTL1KDM4EPKMSMN1; SMN2TSHR
SCHEMBL29735103 0.82 L3MBTL1 (0.57) L3MBTL1KDM4EPKMSMN1; SMN2TSHR
SCHEMBL29735129 0.82 L3MBTL1 (0.57) L3MBTL1KDM4EPKMSMN1; SMN2TSHR
SCHEMBL10084676 0.81 L3MBTL1 (0.77) L3MBTL1KDM4ETSHRHPGDNPSR1
SCHEMBL17213613 0.80 L3MBTL1 (0.75) L3MBTL1KDM4ETSHRHPGDNPSR1
SCHEMBL19317331 0.80 L3MBTL1 (0.55) L3MBTL1KDM4EGAAPKMSMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017155910-A1 THIAZOLIDINONE COMPOUNDS AND USE THEREOF NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2017-09-14 WO disclosed