SCHEMBL11963191

SCHEMBL11963191

CC(C)(C)OC(=O)N1CC2CC1CN2c1cncc(Br)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.48
HDAC1 Q13547 2/20 0.45
PARP1 P09874 1/20 0.45
HSD11B1 P28845 1/20 0.43
RET P07949 2/20 0.41
UCHL1 P09936 1/20 0.40
USP30 Q70CQ3 1/20 0.40
CHRNB2 P17787 2/20 0.38
CHRNA4 P43681 2/20 0.38
F13A1 P00488 1/20 0.38
TGM2 P21980 1/20 0.38
TGM1 P22735 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
MAPK8 P45983 1/20 0.38
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
IDH1 O75874 1/20 0.37
SPR P35270 1/20 0.37
GRM2 Q14416 1/20 0.36

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
SCHEMBL2949364 1.00 GPR119 (0.48) GPR119HDAC1PARP1HSD11B1RET
SCHEMBL7001601 0.86 GPR119 (0.52) GPR119HDAC1PARP1HSD11B1RET
SCHEMBL7145919 0.85 CHRNB2 (0.52) GPR119HDAC1PARP1HSD11B1RET
SCHEMBL4119940 0.83 HSD11B1 (0.39) GPR119HDAC1PARP1HSD11B1UCHL1
SCHEMBL11963216 0.82 PARP1 (0.48) GPR119HDAC1PARP1HSD11B1RET
SCHEMBL2960207 0.82 HDAC1 (0.49) GPR119HDAC1PARP1HSD11B1RET
SCHEMBL2958457 0.82 GPR119 (0.48) GPR119HDAC1PARP1HSD11B1RET
SCHEMBL23551511 0.82 GPR119 (0.50) GPR119HDAC1PARP1HSD11B1RET
SCHEMBL1199629 0.82 GPR119 (0.50) GPR119HDAC1PARP1HSD11B1RET
SCHEMBL1199630 0.82 GPR119 (0.50) GPR119HDAC1PARP1HSD11B1RET

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
EP-2489663-A1 Compounds as syk kinase inhibitors Almirall, S.A. (ES) 2012-08-22 EP disclosed