SCHEMBL5715316

SCHEMBL5715316

Cc1cccc(CCc2ccc(OC(=O)N3CCN(CCCc4cccnc4)CC3)cc2)n1.Cc1cccc(CCc2ccc(OC(=O)N3CCN(CCc4cccnc4)CC3)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
ALOX15 P16050 1/20 0.46
FAAH O00519 6/20 0.44
SIGMAR1 Q99720 3/20 0.44
ADORA3 P0DMS8 1/20 0.44
HTR2A P28223 1/20 0.44
HTR7 P34969 1/20 0.44
OPRM1 P35372 1/20 0.44
MGLL Q99685 2/20 0.43
DRD2 P14416 1/20 0.41
PTAFR P25105 1/20 0.41
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
POLB P06746 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
SCHEMBL6102814 0.98 KDM4E (0.47) KDM4EALDH1A1ALOX15FAAHSIGMAR1
SCHEMBL6103006 0.97 THRB (0.41) KDM4EALDH1A1ALOX15DRD2POLB
SCHEMBL5715116 0.91 KDM4E (0.45) KDM4EALDH1A1ALOX15FAAHSIGMAR1
SCHEMBL5715407 0.90 KDM4E (0.41) KDM4EALDH1A1ALOX15DRD2HRH2
SCHEMBL6102352 0.89 KDM4E (0.50) KDM4EALDH1A1POLB
SCHEMBL5714798 0.88 SIGMAR1 (0.47) FAAHSIGMAR1ADORA3HTR2AHTR7
SCHEMBL6102347 0.86 KCNH2 (0.43) KDM4EFAAHSIGMAR1ADORA3HTR2A
SCHEMBL5714855 0.86 DRD2 (0.47) SIGMAR1ADORA3HTR2AHTR7OPRM1
SCHEMBL5714136 0.86 SIGMAR1 (0.45) KDM4EALDH1A1ALOX15FAAHSIGMAR1
SCHEMBL5715419 0.84 KDM4E (0.47) KDM4EALDH1A1ALOX15FAAHSIGMAR1

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-1636187-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2006-03-22 EP disclosed
WO-2004111004-A1 SUBSTITUTED PIPERAZINE CARBAMATES FOR USE AS INHIBITORS OF HORMONE SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2004-12-23 WO disclosed