SCHEMBL4641231

SCHEMBL4641231

COc1ccc(-c2nc(CC(=O)Cc3ccccc3OC(C)C)co2)cc1OCC(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
THRB P10828 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
S1PR1 P21453 1/20 0.35
LCLAT1 Q6UWP7 2/20 0.35
KMT2A Q03164 4/20 0.34
KDM4E B2RXH2 4/20 0.34
MEN1 O00255 3/20 0.34
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
USP2 O75604 1/20 0.34
MAPT P10636 1/20 0.34
NPY2R P49146 1/20 0.34
TSHR P16473 2/20 0.34
GAA P10253 1/20 0.34
PDE4B Q07343 2/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL4640577 0.93 KDM4E (0.39) LMNATHRBS1PR1KMT2AKDM4E
SCHEMBL4640424 0.90 KDM4E (0.39) LMNATHRBPPARGPPARAS1PR1
SCHEMBL4639873 0.90 LMNA (0.41) LMNATHRBPPARGPPARAS1PR1
SCHEMBL4641238 0.90 LMNA (0.41) LMNATHRBPPARGPPARAS1PR1
SCHEMBL4639512 0.88 LMNA (0.38) LMNATHRBPPARGPPARAS1PR1
SCHEMBL4640682 0.87 PDE4A (0.43) LMNAPPARGPPARAKMT2AKDM4E
SCHEMBL4639554 0.87 PARP1 (0.41) LMNATHRBPPARGPPARAS1PR1
SCHEMBL4641121 0.86 KDM4E (0.42) LMNAS1PR1KMT2AKDM4EMEN1
SCHEMBL5592984 0.86 LMNA (0.36) LMNATHRBPPARGPPARAS1PR1
SCHEMBL4639330 0.85 KDM4E (0.35) LMNATHRBPPARGPPARAS1PR1

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-1954684-A2 OXAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION Otsuka Pharmaceutical Co., Ltd. (JP) 2008-08-13 EP disclosed
WO-2007058338-A9 OXAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMA CO LTD (JP) 2007-11-01 WO disclosed
WO-2007058338-A2 OXAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-05-24 WO disclosed