SCHEMBL4735264

SCHEMBL4735264

CC(C)(C)OC(=O)N1CCC(c2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.54
MAPT P10636 2/20 0.53
KDM4E B2RXH2 1/20 0.53
THRB P10828 1/20 0.53
STS P08842 4/20 0.53
PDE4B Q07343 1/20 0.52
GPR119 Q8TDV5 5/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
DDB1 Q16531 1/20 0.48
CRBN Q96SW2 1/20 0.48
USP2 O75604 1/20 0.47
HPGD P15428 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL14370267 0.93 NAMPT (0.48) NAMPTMAPTKDM4ETHRBSTS
SCHEMBL8355568 0.92 PDE4B (0.61) NAMPTMAPTKDM4ETHRBSTS
SCHEMBL19103523 0.90 NAMPT (0.52) NAMPTMAPTKDM4ETHRBSTS
SCHEMBL19703149 0.90 NAMPT (0.52) NAMPTMAPTKDM4ETHRBSTS
SCHEMBL25202591 0.89 NAMPT (0.51) NAMPTMAPTKDM4ETHRBSTS
SCHEMBL4886160 0.89 TACR3 (0.51) NAMPTMAPTKDM4ETHRBSTS
SCHEMBL15862956 0.89 NAMPT (0.51) NAMPTMAPTKDM4ETHRBSTS
SCHEMBL31342575 0.89 TACR3 (0.51) NAMPTMAPTKDM4ETHRBSTS
SCHEMBL4846419 0.89 MAPT (0.51) NAMPTMAPTKDM4ETHRBSTS
SCHEMBL30412116 0.89 NAMPT (0.51) NAMPTMAPTKDM4ETHRBSTS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008059214-A1 BISAMLDE DERIVATIVES AND USE THEREOF AS FATTY ACID SYNTHASE INHIBITORS ASTRAZENECA AB (SE) 2008-05-22 WO disclosed
EP-0580398-B1 Carbamoyl pyrrolidone derivatives for the treatment of depression and cerebrovascular disorders SHIONOGI & CO (JP) 1999-11-24 EP disclosed
US-5321035-A Antiserotonin, antiischemic agents SHIONOGI & CO., LTD. (JP) 1994-06-14 US disclosed
EP-0580398-A1 Carbamoyl pyrrolidone derivatives for the treatment of depression and cerebnovascular disorders SHIONOGI & CO., LTD. (JP) 1994-01-26 EP disclosed