SCHEMBL7465397

SCHEMBL7465397

CC(C)(C)OC(=O)N(Cc1ccc(C#N)cc1)C(=O)OCc1ccc(C#N)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
RAB9A P51151 1/20 0.40
MAOB P27338 1/20 0.40
NSD2 O96028 1/20 0.40
GAA P10253 2/20 0.39
GPR119 Q8TDV5 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
ABCB1 P08183 2/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA4 P43681 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
EPHX2 P34913 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL1009189 0.92 NSD2 (0.45) RAB9AMAOBNSD2ABCB1CHRNB2
SCHEMBL6424007 0.87 NSD2 (0.43) MAOBNSD2ABCB1EPHX2POLB
SCHEMBL7233237 0.80 NSD2 (0.53) TSHRRAB9ANSD2EPHX2POLB
SCHEMBL1009190 0.77 NSD2 (0.42) RAB9AMAOBNSD2GPR119ABCB1
SCHEMBL7204913 0.76 MLYCD (0.36) MAOBNSD2ABCB1CHRNB2CHRNB4
SCHEMBL1010216 0.76 MEP1A (0.50) MAOBABCB1
SCHEMBL2578969 0.76 NSD2 (0.41) TSHRMAOBNSD2CHRNB2CHRNB4
SCHEMBL30577123 0.75 SSTR4 (0.47) NSD2GPR119EPHX2POLB
SCHEMBL407573 0.75 ABCB1 (0.44) NSD2GPR119ABCB1EPHX2POLB
SCHEMBL4662657 0.75 HDAC3 (0.46) TSHRRAB9ANSD2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000032574-A1 NOVEL 2-PYRIDONE DERIVATIVES, PREPARATION METHOD AND THERAPEUTIC USE SANOFI-SYNTHELABO (FR) 2000-06-08 WO disclosed