SCHEMBL8237292

SCHEMBL8237292

CCOc1cc(-c2nc(CCC(=O)c3ccccc3O)co2)ccc1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPT P10636 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GAA P10253 1/20 0.42
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
LMNA P02545 5/20 0.40
KDM4E B2RXH2 4/20 0.40
HSD17B10 Q99714 4/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
PKM P14618 2/20 0.39
MAPK1 P28482 2/20 0.39
CASP1 P29466 1/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38

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
SCHEMBL4271825 0.95 KDM4E (0.43) ALDH1A1MAPTS1PR1S1PR3LMNA
SCHEMBL4270743 0.92 SMN1; SMN2 (0.45) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL4280633 0.92 SMN1; SMN2 (0.45) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL4277709 0.91 SMN1; SMN2 (0.43) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL13701424 0.90 SMN1; SMN2 (0.45) SMN1; SMN2POLBMAPTMEN1KMT2A
SCHEMBL4275365 0.90 KDM4E (0.44) SMN1; SMN2POLBALDH1A1MAPTLMNA
SCHEMBL13701431 0.90 SMN1; SMN2 (0.43) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL4281082 0.89 MAPT (0.43) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL4271880 0.89 TSHR (0.41) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL4271315 0.88 FPR2 (0.40) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A

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-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