SCHEMBL4639873

SCHEMBL4639873

CCOc1cc(-c2nc(CC(=O)Cc3ccccc3OCC(F)(F)F)co2)ccc1OC

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
KDM4E B2RXH2 2/20 0.41
HSD17B10 Q99714 2/20 0.41
USP2 O75604 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
FPR2 P25090 1/20 0.38
TSHR P16473 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
THRB P10828 1/20 0.38
POLB P06746 2/20 0.37
CFTR P13569 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL4641238 1.00 LMNA (0.41) LMNAKDM4EHSD17B10USP2MAPT
SCHEMBL4640577 0.95 KDM4E (0.39) LMNAKDM4EHSD17B10USP2MAPT
SCHEMBL5592710 0.90 S1PR1 (0.41) LMNAKDM4EHSD17B10USP2MAPT
SCHEMBL4641231 0.90 LMNA (0.36) LMNAKDM4EHSD17B10USP2MAPT
SCHEMBL4639422 0.89 SMN1; SMN2 (0.42) LMNAKDM4EHSD17B10USP2MAPT
SCHEMBL4640052 0.88 KDM4E (0.46) LMNAKDM4EHSD17B10S1PR1S1PR3
SCHEMBL4639814 0.88 KDM4E (0.41) LMNAKDM4EHSD17B10USP2MAPT
SCHEMBL4639925 0.87 KDM4E (0.41) LMNAKDM4EHSD17B10USP2MAPT
SCHEMBL4639660 0.87 KDM4E (0.41) LMNAKDM4EHSD17B10USP2MAPT
SCHEMBL4641121 0.86 KDM4E (0.42) LMNAKDM4EHSD17B10USP2MAPT

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