SCHEMBL13876134

SCHEMBL13876134

COc1ccc(-n2c(=O)[nH]c3c(N4CCN(C(=O)OC(C)(C)C)CC4)ncnc32)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.52
SLC2A3 P11169 2/20 0.52
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
KIT P10721 4/20 0.45
GPR119 Q8TDV5 4/20 0.44
MAPT P10636 5/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 3/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
PIK3CD O00329 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 2/20 0.38
KDM4E B2RXH2 1/20 0.38
IDE P14735 1/20 0.38
HIF1A Q16665 1/20 0.38

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
SCHEMBL13875758 0.82 SLC2A1 (0.55) SLC2A1SLC2A3MAPTALDH1A1LMNA
SCHEMBL3874202 0.79 KIT (0.52) SLC2A1SLC2A3CNR1CNR2KIT
SCHEMBL30947672 0.79 GPR119 (0.64) GPR119MAPTALDH1A1LMNASMN1; SMN2
SCHEMBL2120938 0.79 GPR119 (0.64) GPR119MAPTALDH1A1LMNASMN1; SMN2
SCHEMBL3874827 0.77 GPR119 (0.41) SLC2A1SLC2A3CNR1CNR2KIT
SCHEMBL6356496 0.75 GPR119 (0.59) GPR119MAPTALDH1A1LMNASMN1; SMN2
SCHEMBL3883186 0.72 KIT (0.45) SLC2A1SLC2A3CNR1CNR2KIT
SCHEMBL20423342 0.70 GPR119 (0.50) GPR119MAPTALDH1A1LMNASMN1; SMN2
SCHEMBL30672845 0.70 GPR119 (0.50) GPR119MAPTALDH1A1LMNASMN1; SMN2
SCHEMBL1584044 0.70 GPR119 (0.48) GPR119MAPTALDH1A1LMNAPIK3CD

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
US-7524847-B2 Fused 1,3-dihydro-imidazole ring compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-04-28 US disclosed