SCHEMBL4639705

SCHEMBL4639705

O=C(O)C(Cc1coc(-c2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)n1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HSD17B10 Q99714 2/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PPARA Q07869 4/20 0.43
PPARG P37231 3/20 0.43
FFAR1 O14842 3/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
MAP4K4 O95819 1/20 0.40
PTGER1 P34995 1/20 0.40

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
SCHEMBL4277034 0.91 KDM4E (0.46) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL4274912 0.87 PDE4A (0.48) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL4271887 0.85 TSHR (0.42) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL4639334 0.84 FFAR1 (0.55) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL4271329 0.84 TSHR (0.40) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL4270619 0.82 KDM4E (0.49) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL4280265 0.81 PDE4A (0.43) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL4281141 0.81 KDM4E (0.39) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL4277665 0.81 KDM4E (0.47) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL4274964 0.80 KDM4E (0.43) TSHRKDM4EALDH1A1HSD17B10MAPT

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