SCHEMBL1737884

SCHEMBL1737884

CN1CCN(c2ccc(F)cc2CC2CCN(c3ccc(C(C)(O)S(C)(=O)=O)nc3)C2=O)CC1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.36
MAPK7 Q13164 2/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
LRRK2 Q5S007 1/20 0.36
ROCK2 O75116 1/20 0.35
HSD11B1 P28845 2/20 0.35
ALDH1A1 P00352 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
DPP4 P27487 1/20 0.34
TNK2 Q07912 1/20 0.34
GAA P10253 1/20 0.34
HTR2A P28223 2/20 0.34
FGFR4 P22455 1/20 0.34
CCNA2 P20248 1/20 0.34
CDK2 P24941 1/20 0.34
CDK5 Q00535 1/20 0.34
CDK5R1 Q15078 1/20 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
SCHEMBL1737881 1.00 HTR6 (0.36) HTR6MAPK7NR1H2NR1H3LRRK2
SCHEMBL1737882 1.00 HTR6 (0.36) HTR6MAPK7NR1H2NR1H3LRRK2
SCHEMBL1737851 0.92 DPP4 (0.38) HTR6MAPK7LRRK2ROCK2ALDH1A1
SCHEMBL1738502 0.92 DPP4 (0.38) HTR6MAPK7LRRK2ROCK2ALDH1A1
SCHEMBL1738798 0.92 DPP4 (0.38) HTR6MAPK7LRRK2ROCK2ALDH1A1
SCHEMBL1737782 0.87 DPP4 (0.37) MAPK7LRRK2ALDH1A1L3MBTL1DPP4
SCHEMBL1738829 0.87 DPP4 (0.37) MAPK7LRRK2ALDH1A1L3MBTL1DPP4
SCHEMBL1737221 0.87 DPP4 (0.37) MAPK7LRRK2ALDH1A1L3MBTL1DPP4
SCHEMBL1737249 0.82 ALDH1A1 (0.40) HTR6MAPK7LRRK2ROCK2HSD11B1
SCHEMBL1737246 0.82 ALDH1A1 (0.40) HTR6MAPK7LRRK2ROCK2HSD11B1

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-1727794-B1 NOVEL BENZYL(IDENE)-LACTAM DERIVATIVES PFIZER PROD INC (US) 2011-11-16 EP claimed
US-20110263484-A1 SINGLE CHAIN FC TYPE III INTERFERONS AND METHODS OF USING SAME ZYMOGENETICS, INC. 2011-10-27 US claimed