SCHEMBL13537962

SCHEMBL13537962

CC(C)(C)OC(=O)N1CCN(c2ccc(C(C)(F)F)cc2/C=C2\SC(=O)NC2=O)CC1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 4/20 0.49
▸ PIM1 P11309 5/20 0.49
▸ PIM2 Q9P1W9 5/20 0.49
▸ PIM3 Q86V86 4/20 0.49
▸ NR1H4 Q96RI1 3/20 0.43
▸ PTPN1 P18031 5/20 0.41
▸ POLB P06746 1/20 0.39
▸ PDK2 Q15119 1/20 0.39
▸ GSK3B P49841 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
SCHEMBL2425656 0.94 GPR119 (0.49) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL2425657 0.94 GPR119 (0.49) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL12282967 0.87 GPR119 (0.51) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL13537792 0.85 PIM1 (0.48) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL2428104 0.84 PIM1 (0.66) GPR119PIM1PIM2PIM3GSK3B
SCHEMBL2424864 0.84 PIM1 (0.66) GPR119PIM1PIM2PIM3GSK3B
SCHEMBL2426618 0.83 PIM1 (0.45) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL2426616 0.83 PIM1 (0.45) GPR119PIM1PIM2PIM3NR1H4
SCHEMBL13537641 0.83 PIM1 (0.63) PIM1PIM2PIM3NR1H4PTPN1
SCHEMBL2428210 0.81 PIM2 (0.61) GPR119PIM1PIM2PIM3

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-2010001169-A2 CHEMICAL COMPOUNDS 251 ASTRAZENECA AB (SE) 2010-01-07 — — WO disclosed
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