SCHEMBL27907902

SCHEMBL27907902

CC(C)(C)OC(=O)n1nc(N2C(=O)c3ccccc3C2=O)c2cc(C(F)(F)F)ccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 1/20 0.55
DNMT1 P26358 3/20 0.37
JAK2 O60674 3/20 0.35
JAK3 P52333 3/20 0.35
PTK2 Q05397 3/20 0.35
PDE2A O00408 1/20 0.35
MAPT P10636 1/20 0.35
NR1H2 P55055 1/20 0.35
GPR119 Q8TDV5 2/20 0.34
TACR1 P25103 1/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
MASP2 O00187 1/20 0.34
F2 P00734 1/20 0.34
NR1H3 Q13133 2/20 0.33
PGR P06401 1/20 0.33
SRC P12931 1/20 0.33
KCNMA1 Q12791 1/20 0.33

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
SCHEMBL2634265 0.83 CCR2 (0.38) MAP2K4DNMT1PDE2APDE4APDE4B
SCHEMBL22801552 0.80 MAP2K4 (0.60) MAP2K4JAK2JAK3PTK2MAPT
SCHEMBL2634290 0.79 PDE2A (0.40) DNMT1PDE2AMASP2F2NR1H3
SCHEMBL15708456 0.79 MAP2K4 (0.61) MAP2K4MAPTNR1H2GPR119
SCHEMBL16800427 0.78 MAP2K4 (0.62) MAP2K4MAPTGPR119
SCHEMBL14487511 0.75 MAP2K4 (0.57) MAP2K4JAK2MAPTNR1H2GPR119
SCHEMBL13736017 0.75 CA12 (0.34) MAP2K4MAPTNR1H2
SCHEMBL20402734 0.74 MAP2K4 (0.32) MAP2K4MAPT
SCHEMBL22801706 0.73 MAP2K4 (0.68) MAP2K4MAPT
SCHEMBL1513075 0.73 MAP2K4 (0.52) MAP2K4MAPTGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102933575-A Yclohexyl-azetidinyl antagonists of ccr2 JANSSEN PHARMACEUTICA NV 2013-02-13 CN disclosed