SCHEMBL4686192

SCHEMBL4686192

CCCCN1CCC(Oc2ccc(C(=O)Nc3ccc(Oc4ccc(NC(=O)NC(CC)CC)cc4OCC)cc3)cc2)C1.CCOc1cc(NC(=O)NC(CC)CC)ccc1Oc1ccc(NC(=O)c2ccc(OC3CCN(N(C)C)CC3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.41
MCHR1 Q99705 2/20 0.36
FGFR1 P11362 5/20 0.35
MAPT P10636 2/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
FAAH O00519 1/20 0.34
EPHX2 P34913 1/20 0.34
ACACB O00763 1/20 0.34
CSF1R P07333 1/20 0.34
PDGFRB P09619 1/20 0.34
KIT P10721 1/20 0.34
PDGFRA P16234 1/20 0.34
FLT3 P36888 1/20 0.34
SSTR5 P35346 1/20 0.34
EHMT2 Q96KQ7 2/20 0.34

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
SCHEMBL4237517 0.95 CCR3 (0.45) CCR3MCHR1FGFR1MAPTHPGD
SCHEMBL4745650 0.93 CCR3 (0.37) CCR3MCHR1MAPTHPGDTSHR
SCHEMBL4234129 0.92 MCHR1 (0.42) CCR3MCHR1FGFR1MAPTHPGD
SCHEMBL4229363 0.92 PKM (0.39) MCHR1MAPTTSHRHSD17B10MEN1
SCHEMBL4236062 0.86 MCHR1 (0.47) MCHR1FGFR1MAPTMEN1KMT2A
SCHEMBL4233894 0.86 MCHR1 (0.47) MCHR1FGFR1MAPTMEN1KMT2A
SCHEMBL4233712 0.85 MAPT (0.38) CCR3MCHR1MAPTHPGDTSHR
SCHEMBL4242394 0.85 TAS1R3 (0.43) MCHR1MAPTTSHRHSD17B10MEN1
SCHEMBL4229397 0.85 MCHR1 (0.44) MCHR1MAPTMEN1KMT2A
SCHEMBL4240513 0.84 MCHR1 (0.40) MCHR1MAPTHPGDTSHRTAAR1

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