SCHEMBL4566639

SCHEMBL4566639

O=C(O)c1cc(C2CCCCC2)c2c(C(=O)O)c1CC2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.43
CAMKK2 Q96RR4 5/20 0.40
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KMO O15229 2/20 0.37
HSD17B10 Q99714 1/20 0.35
CAMKK1 Q8N5S9 3/20 0.34
PTGDR2 Q9Y5Y4 6/20 0.34
PTGDR Q13258 3/20 0.34
KDM5A P29375 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
PTGER2 P43116 1/20 0.34
DHODH Q02127 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
SCHEMBL253754 0.87 ACMSD (0.43) ACMSDCAMKK2MAPTKDM4EMEN1
SCHEMBL12478008 0.85 ACMSD (0.41) ACMSDCAMKK2MAPTKDM4EMEN1
SCHEMBL2443029 0.77 ACMSD (0.43) ACMSDCAMKK2MAPTKDM4EMEN1
SCHEMBL9823221 0.75 ACMSD (0.44) ACMSDCAMKK2MAPTKDM4EMEN1
SCHEMBL14989275 0.75 ACMSD (0.44) ACMSDCAMKK2MAPTKDM4EMEN1
SCHEMBL14989246 0.75 ACMSD (0.44) ACMSDCAMKK2MAPTKDM4EMEN1
SCHEMBL27492056 0.74 ACMSD (0.43) ACMSDCAMKK2MAPTKDM4EMEN1
SCHEMBL3258518 0.74 ACMSD (0.43) ACMSDCAMKK2MAPTKDM4EMEN1
SCHEMBL10696750 0.73 KDM4E (0.47) ACMSDCAMKK2MAPTKDM4EMEN1
SCHEMBL14989244 0.72 KMO (0.45) ACMSDCAMKK2MAPTKDM4EMEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893979-A4 MOLECULARLY IMPRINTED POLYMER AND USE THEREOF IN DIAGNOSTIC DEVICES ADHESIVES RES INC (US) 2009-07-15 EP disclosed
EP-1893979-A1 MOLECULARLY IMPRINTED POLYMER AND USE THEREOF IN DIAGNOSTIC DEVICES Adhesives Research, Inc. (US) 2008-03-05 EP disclosed
WO-2007002237-A1 MOLECULARLY IMPRINTED POLYMER AND USE THEREOF IN DIAGNOSTIC DEVICES ADHESIVES RESEARCH, INC. (US) 2007-01-04 WO disclosed
EP-1390750-A4 HYDROPHILIC DIAGNOSTIC DEVICES FOR USE IN THE ASSAYING OF BIOLOGICAL FLUIDS ADHESIVES RES INC (US) 2004-12-22 EP disclosed
EP-1390750-A2 HYDROPHILIC DIAGNOSTIC DEVICES FOR USE IN THE ASSAYING OF BIOLOGICAL FLUIDS ADHESIVES RESEARCH, INC. (US) 2004-02-25 EP disclosed
WO-2002085185-A2 HYDROPHILIC DIAGNOSTIC DEVICES ADHESIVES RESEARCH, INC. (US) 2002-10-31 WO disclosed