SCHEMBL4688677

SCHEMBL4688677

CCCCCNC(=O)Nc1ccc(OC)c(Oc2ccc(NC(=O)c3ccc(OC4CCN(C(C)C)CC4)cc3)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 8/20 0.48
SLC5A7 Q9GZV3 5/20 0.47
CYP2D6 P10635 1/20 0.45
POLB P06746 1/20 0.44
RAB9A P51151 1/20 0.43
QPCT Q16769 1/20 0.43

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
SCHEMBL4687069 0.97 HRH3 (0.48) HRH3SLC5A7CYP2D6
SCHEMBL4683166 0.97 HRH3 (0.48) HRH3SLC5A7CYP2D6
SCHEMBL4784378 0.93 SLC5A7 (0.45) SLC5A7CYP2D6RAB9AQPCT
SCHEMBL4683735 0.91 QPCT (0.43) HRH3SLC5A7RAB9AQPCT
SCHEMBL4682983 0.91 HRH3 (0.56) HRH3
SCHEMBL4687209 0.87 HRH3 (0.41) HRH3RAB9AQPCT
SCHEMBL4234320 0.87 HRH3 (0.48) HRH3SLC5A7CYP2D6POLBRAB9A
SCHEMBL4683393 0.86 FGFR1 (0.48) RAB9AQPCT
SCHEMBL4683459 0.84 MAPT (0.45) RAB9AQPCT
SCHEMBL4687404 0.84 MCHR1 (0.47) QPCT

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-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP claimed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO claimed