SCHEMBL5510550

SCHEMBL5510550

CN(CCc1ccccc1)C(=O)CN1CC2C(CNC(=O)c3cccc(OC(F)(F)F)c3)C2C1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 1/20 0.43
CHRM3 P20309 1/20 0.43
NAMPT P43490 2/20 0.43
MAPK14 Q16539 1/20 0.42
CCR2 P41597 1/20 0.42
SCN9A Q15858 1/20 0.42
CHRM4 P08173 3/20 0.42
SLC5A7 Q9GZV3 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
TAS1R2 Q8TE23 1/20 0.40
SLC6A9 P48067 1/20 0.40
KCNH2 Q12809 1/20 0.40
LTB4R Q15722 1/20 0.39
LTB4R2 Q9NPC1 1/20 0.39
MCHR1 Q99705 1/20 0.39
KAT6A Q92794 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
SCHEMBL15967025 0.92 GPR139 (0.44) GPR139CHRM3NAMPTMAPK14CCR2
SCHEMBL15966927 0.87 NAMPT (0.44) GPR139CHRM3NAMPTCCR2TAS1R3
SCHEMBL5517992 0.87 NAMPT (0.46) GPR139CHRM3NAMPTMAPK14CCR2
SCHEMBL5504910 0.87 SLC6A9 (0.42) GPR139CHRM3NAMPTCCR2TAS1R3
SCHEMBL5510551 0.86 LTB4R (0.43) MAPK14SCN9ACHRM4SLC6A9KCNH2
SCHEMBL5511231 0.86 NAMPT (0.50) GPR139CHRM3NAMPTMAPK14CCR2
SCHEMBL5509495 0.85 CCR2 (0.44) GPR139CHRM3NAMPTCCR2TAS1R3
SCHEMBL5517618 0.84 NAMPT (0.48) GPR139CHRM3NAMPTMAPK14CCR2
SCHEMBL5530668 0.84 NAMPT (0.46) GPR139CHRM3NAMPTCCR2CHRM4
SCHEMBL5506350 0.83 CCR2 (0.41) GPR139CHRM3NAMPTCCR2KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP claimed
EP-1869019-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS Pfizer Products Incorporated (US) 2007-12-26 EP claimed
WO-2006106425-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PRODUCTS INC. (US) 2006-10-12 WO claimed
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP disclosed