SCHEMBL5509524

SCHEMBL5509524

CCOc1ccc(CN2CC3C(CNC(=O)c4cccc(OC(F)(F)F)c4)C3C2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 4/20 0.52
CHRM3 P20309 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 3/20 0.47
NPC1 O15118 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
TEAD1 P28347 1/20 0.46
MCHR1 Q99705 2/20 0.45
ABL1 P00519 1/20 0.44
KCNH2 Q12809 1/20 0.44
DRD2 P14416 1/20 0.44
DRD4 P21917 1/20 0.44
HTR2A P28223 1/20 0.44
DDR1 Q08345 1/20 0.43
NAMPT P43490 1/20 0.43
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 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
SCHEMBL5510670 0.93 CCR2 (0.51) CCR2CHRM3MAPK1TEAD1MCHR1
SCHEMBL5512182 0.93 CCR2 (0.55) CCR2CHRM3TEAD1MCHR1ABL1
SCHEMBL5513310 0.91 CCR2 (0.53) CCR2CHRM3TEAD1MCHR1ABL1
SCHEMBL15967010 0.90 CCR2 (0.54) CCR2CHRM3TEAD1MCHR1ABL1
SCHEMBL5511190 0.89 CCR2 (0.53) CCR2CHRM3RAB9ATEAD1MCHR1
SCHEMBL5510926 0.89 CCR2 (0.64) CCR2CHRM3TEAD1MCHR1DRD4
SCHEMBL5514654 0.89 CCR2 (0.55) CCR2CHRM3TEAD1MCHR1ABL1
SCHEMBL5505979 0.88 CCR2 (0.53) CCR2CHRM3SMN1; SMN2LMNATEAD1
SCHEMBL5510875 0.88 CCR2 (0.53) CCR2CHRM3TEAD1MCHR1ABL1
SCHEMBL5518151 0.88 CCR2 (0.54) CCR2CHRM3SMN1; SMN2LMNATEAD1

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