SCHEMBL16104792

SCHEMBL16104792

Bc1ccc(CNC(=O)OC(C)(C)C)cc1C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
NAMPT P43490 2/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
NR1H4 Q96RI1 1/20 0.44
GAA P10253 1/20 0.44
TSHR P16473 2/20 0.43
HDAC1 Q13547 1/20 0.43
GRM2 Q14416 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GLS O94925 2/20 0.42
BRD4 O60885 1/20 0.42
CYP3A4 P08684 1/20 0.40
BRD9 Q9H8M2 1/20 0.40
BAZ2B Q9UIF8 1/20 0.40
BAZ2A Q9UIF9 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
SCHEMBL14144563 0.84 HDAC1 (0.52) KDM4AL3MBTL1NAMPTCA1CA2
SCHEMBL850268 0.83 MEN1 (0.47) KDM4AL3MBTL1NAMPTCA1CA2
SCHEMBL16020300 0.83 MMP13 (0.54) KDM4AL3MBTL1NAMPTGAATSHR
SCHEMBL31431173 0.83 HDAC1 (0.47) KDM4AL3MBTL1NAMPTCA1CA2
SCHEMBL31019193 0.82 NR1H4 (0.62) KDM4AL3MBTL1NAMPTCA1CA2
SCHEMBL3897985 0.82 NR1H4 (0.62) KDM4AL3MBTL1NAMPTCA1CA2
SCHEMBL13691717 0.82 GRM2 (0.47) KDM4AL3MBTL1NAMPTCA1CA2
SCHEMBL4145619 0.82 KDM4A (0.47) KDM4AL3MBTL1NAMPTCA1CA2
SCHEMBL21241667 0.81 NSD2 (0.44) KDM4AL3MBTL1NAMPTCA1CA2
SCHEMBL1829911 0.81 TSHR (0.59) KDM4AL3MBTL1NAMPTNR1H4GAA

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-2433940-B9 SPIROIMIDAZOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2015-10-28 EP disclosed
EP-2433940-B1 SPIROIMIDAZOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2014-09-24 EP disclosed