SCHEMBL6259732

SCHEMBL6259732

N#Cc1ccc(N2CCCC(C3CCCCC3)C2)nc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.50
AR P10275 1/20 0.49
CHRM4 P08173 1/20 0.43
PANK3 Q9H999 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SMO Q99835 5/20 0.42
DPP4 P27487 2/20 0.41
DPP8 Q6V1X1 1/20 0.41
DPP9 Q86TI2 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
HTR7 P34969 1/20 0.41
JAK2 O60674 2/20 0.39
JAK1 P23458 2/20 0.39
TYK2 P29597 2/20 0.39
JAK3 P52333 2/20 0.39
EGLN2 Q96KS0 1/20 0.39

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
SCHEMBL6234134 0.93 GPR119 (0.57) GPR119ARCHRM4PANK3KDM4E
SCHEMBL2224211 0.82 MAP4K4 (0.50) GPR119KDM4EALDH1A1L3MBTL1SMO
SCHEMBL29462081 0.82 RET (0.48) GPR119CHRM4PANK3KDM4EALDH1A1
SCHEMBL3051541 0.81 CNR2 (0.54) GPR119ARPANK3KDM4EALDH1A1
SCHEMBL29514660 0.79 KDM4E (0.54) GPR119PANK3KDM4EALDH1A1L3MBTL1
SCHEMBL14844043 0.79 SMO (0.56) GPR119PANK3KDM4EALDH1A1L3MBTL1
SCHEMBL3048925 0.79 KDM4E (0.54) GPR119PANK3KDM4EALDH1A1L3MBTL1
SCHEMBL12683464 0.79 GPR119 (0.46) GPR119CHRM4PANK3KDM4EALDH1A1
SCHEMBL6232964 0.79 MAP4K4 (0.52) GPR119PANK3KDM4EALDH1A1L3MBTL1
SCHEMBL21135514 0.79 MAP4K4 (0.52) GPR119CHRM4PANK3KDM4EALDH1A1

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
WO-2005005382-A2 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2005-01-20 WO disclosed