SCHEMBL5984433

SCHEMBL5984433

COC(=O)COC1(CN)C=CC(c2ccccc2)=CC1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.36
CACNA1G O43497 3/20 0.33
AKT1 P31749 3/20 0.32
AKT2 P31751 3/20 0.32
GAA P10253 2/20 0.32
GLA P06280 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RCE1 Q9Y256 1/20 0.32
CYP2C19 P33261 1/20 0.32
FAAH O00519 1/20 0.31
PRNP P04156 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 1/20 0.31
CYP2C9 P11712 1/20 0.31

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
SCHEMBL5983320 0.73 ALDH1A1 (0.34) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL27893814 0.72
Hydrochloric Acid SCHEMBL6495311 0.72 ANPEP (0.35) ALDH1A1KMT2AGLA
SCHEMBL29053322 0.71 MEN1 (0.38) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL8970782 0.71 MEN1 (0.38) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL8407171 0.71 LTA4H (0.39) CACNA1GPOLB
SCHEMBL32679840 0.70 CHRM2 (0.32) CYP2C19L3MBTL1CYP2C9
SCHEMBL10715865 0.70
SCHEMBL4459328 0.70 SRR (0.32)
SCHEMBL5182782 0.70 MEN1 (0.39) ALDH1A1KDM4EMEN1KMT2AMAPT

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
EP-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP disclosed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 WO disclosed