SCHEMBL4688476

SCHEMBL4688476

CCCCCNC(=O)Nc1ccc(Oc2ccc(NC(=O)c3ccc(OC4CCN(CCCC)CC4)cc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.51
MAPT P10636 4/20 0.50
OPRM1 P35372 2/20 0.48
OPRD1 P41143 2/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 1/20 0.48
LMNA P02545 1/20 0.48
HRH3 Q9Y5N1 4/20 0.46
MCHR2 Q969V1 2/20 0.45
MCHR1 Q99705 2/20 0.45
CCR2 P41597 1/20 0.45
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CHRM4 P08173 1/20 0.44
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 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
SCHEMBL4686982 0.91 CCR3 (0.49) CCR3MAPTOPRM1OPRD1MEN1
SCHEMBL4686596 0.90 CCR3 (0.57) CCR3MAPTOPRM1OPRD1MEN1
SCHEMBL4683722 0.90 MAPT (0.49) CCR3MAPTOPRM1OPRD1MEN1
SCHEMBL4683553 0.90 CCR3 (0.49) CCR3MAPTOPRM1OPRD1MEN1
SCHEMBL4684519 0.89 MAPT (0.45) CCR3MAPTHRH3MCHR2MCHR1
SCHEMBL4688687 0.89 CCR3 (0.48) CCR3MAPTOPRM1OPRD1MEN1
SCHEMBL4688148 0.88 CCR3 (0.49) CCR3MAPTOPRM1OPRD1MEN1
SCHEMBL4682983 0.88 HRH3 (0.56) CCR3MAPTLMNAHRH3
SCHEMBL4683919 0.88 CCR3 (0.50) CCR3MAPTOPRM1OPRD1MEN1
SCHEMBL4235491 0.87 HRH3 (0.48) MAPTOPRM1OPRD1MEN1ALDH1A1

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 disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO disclosed