SCHEMBL4600115

SCHEMBL4600115

Nc1ccc(CCCCC2CCN(C(=O)O)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.44
OPRK1 P41145 1/20 0.43
SPHK1 Q9NYA1 2/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
SLC18A3 Q16572 1/20 0.41
HDAC6 Q9UBN7 4/20 0.41
HDAC3 O15379 3/20 0.41
HDAC4 P56524 3/20 0.41
HDAC1 Q13547 3/20 0.41
HDAC7 Q8WUI4 3/20 0.41
HDAC2 Q92769 3/20 0.41
HDAC10 Q969S8 3/20 0.41
HDAC11 Q96DB2 3/20 0.41
HDAC8 Q9BY41 3/20 0.41
HDAC9 Q9UKV0 3/20 0.41
HDAC5 Q9UQL6 3/20 0.41
KDM1A O60341 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
FAAH O00519 1/20 0.39

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
SCHEMBL15954401 0.90 MAOB (0.47) MAOBFAAHCCR3
SCHEMBL3867303 0.83 KDM4E (0.44) OPRK1KDM4EALDH1A1SLC18A3HDAC6
SCHEMBL9051255 0.82 SLC18A3 (0.58) OPRK1KDM4EALDH1A1SLC18A3HDAC6
SCHEMBL1575563 0.82 GPR119 (0.54) KDM4EALDH1A1FAAH
SCHEMBL1582103 0.82 FAAH (0.52) MAOBOPRK1SLC18A3HDAC6KDM1A
SCHEMBL28772160 0.82 GPR119 (0.54)
SCHEMBL27953755 0.81 MEN1 (0.54) FAAHCCR3
SCHEMBL10296248 0.80 FAAH (0.42) MAOBOPRK1SPHK1KDM4EALDH1A1
SCHEMBL1581904 0.80 MAOB (0.49) MAOBOPRK1SLC18A3HDAC6HDAC1
SCHEMBL26641460 0.79 CPB1 (0.46) OPRK1KDM4EALDH1A1SLC18A3HDAC6

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-1910290-A2 GPCR AGONISTS Prosidion Limited (GB) 2008-04-16 EP disclosed
WO-2007003962-A2 GPCR AGONISTS PROSIDION LIMITED (GB) 2007-01-11 WO disclosed