SCHEMBL5518151

SCHEMBL5518151

CC(C)c1ccc(CN2CC3C(CNC(=O)c4cccc(OC(F)(F)F)c4)C3C2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 2/20 0.54
GPR139 Q6DWJ6 1/20 0.48
CHRM3 P20309 1/20 0.47
MCHR1 Q99705 3/20 0.45
TEAD1 P28347 1/20 0.43
DDR1 Q08345 1/20 0.43
NAMPT P43490 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
DRD4 P21917 2/20 0.42
CACNA1H O95180 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
TAS1R2 Q8TE23 1/20 0.42
DRD2 P14416 1/20 0.42
HTR2A P28223 1/20 0.42
KCNH2 Q12809 2/20 0.42
ABL1 P00519 1/20 0.42
ACACB O00763 1/20 0.42
MEN1 O00255 1/20 0.41

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
SCHEMBL5510926 0.91 CCR2 (0.64) CCR2CHRM3MCHR1TEAD1DDR1
SCHEMBL5512182 0.91 CCR2 (0.55) CCR2GPR139CHRM3MCHR1TEAD1
SCHEMBL15967010 0.90 CCR2 (0.54) CCR2GPR139CHRM3MCHR1TEAD1
SCHEMBL5513310 0.89 CCR2 (0.53) CCR2CHRM3MCHR1TEAD1NAMPT
SCHEMBL5514654 0.89 CCR2 (0.55) CCR2GPR139CHRM3MCHR1TEAD1
SCHEMBL5505979 0.88 CCR2 (0.53) CCR2GPR139CHRM3MCHR1TEAD1
SCHEMBL5509524 0.88 CCR2 (0.52) CCR2CHRM3MCHR1TEAD1DDR1
SCHEMBL5511190 0.87 CCR2 (0.53) CCR2GPR139CHRM3MCHR1TEAD1
SCHEMBL5509369 0.87 CCR2 (0.53) CCR2GPR139CHRM3MCHR1TEAD1
SCHEMBL15967033 0.87 CCR2 (0.56) CCR2CHRM3MCHR1TEAD1DDR1

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