SCHEMBL4743336

SCHEMBL4743336

CC(C)(C)Oc1ccc(COCCBr)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.36
TDP1 Q9NUW8 1/20 0.36
PPARG P37231 5/20 0.34
PPARA Q07869 5/20 0.34
ACACB O00763 1/20 0.34
APP P05067 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
IDO1 P14902 2/20 0.32
AGXT P21549 2/20 0.32
PPARD Q03181 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
PTPN2 P17706 1/20 0.32
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 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
SCHEMBL21483755 0.80 TSHR (0.43) L3MBTL1TDP1NPC1MAPTRAB9A
SCHEMBL1427941 0.79 TDP1 (0.54) L3MBTL1TDP1APPSMN1; SMN2IDO1
SCHEMBL18745349 0.79 L3MBTL1 (0.41) L3MBTL1TDP1PPARGPPARAACACB
SCHEMBL5284810 0.79 L3MBTL1 (0.41) L3MBTL1TDP1PPARGPPARAACACB
SCHEMBL22986985 0.78 PPARG (0.36) PPARGPPARAACACBAPPIDO1
SCHEMBL4221559 0.78 APP (0.46) L3MBTL1APPNPC1RAB9ASMN1; SMN2
SCHEMBL4140242 0.77 MEN1 (0.47) TDP1PPARGPPARAACACBPPARD
SCHEMBL2970086 0.77 KDM4E (0.41) PPARGPPARANPC1MAPTRAB9A
SCHEMBL2464668 0.77 PPARA (0.40) PPARGPPARAACACBAPPIDO1
SCHEMBL1179919 0.75 AGXT (0.50) NPC1RAB9ASMN1; SMN2IDO1AGXT

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
WO-2008096093-A1 OXAZOLE AND THIAZOLE DERIVATIVES AND THEIR USES ARGENTA DISCOVERY LTD. (GB) 2008-08-14 WO disclosed
WO-2008096093-A1 OXAZOLE AND THIAZOLE DERIVATIVES AND THEIR USES ARGENTA DISCOVERY LTD. (GB) 2008-08-14 WO disclosed