SCHEMBL19785042

SCHEMBL19785042

Cc1nnn2c1CN(C(=O)OC(C)(C)C)C(C)C2

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 1/20 0.35
▸ GPR119 Q8TDV5 6/20 0.34
▸ SETD7 Q8WTS6 1/20 0.33
▸ HSD11B1 P28845 1/20 0.33
▸ FAAH O00519 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ HDAC1 Q13547 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ NR1H2 P55055 1/20 0.32

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
SCHEMBL19784974 0.86 MAP4K4 (0.34) MAP4K4GPR119SETD7HSD11B1FAAH
SCHEMBL21260292 0.78 GPR119 (0.37) MAP4K4GPR119SETD7HSD11B1HDAC1
SCHEMBL19785152 0.77 CALCA (0.32) MAP4K4GPR119SETD7ALDH1A1
SCHEMBL19632326 0.76 GPR119 (0.38) MAP4K4GPR119SETD7HSD11B1HDAC1
SCHEMBL21058315 0.76 GPR119 (0.38) MAP4K4GPR119SETD7HSD11B1HDAC1
SCHEMBL17936825 0.74 HDAC1 (0.39) MAP4K4GPR119SETD7HSD11B1HDAC1
SCHEMBL20691685 0.74 MEN1 (0.39) MAP4K4GPR119SETD7HSD11B1HDAC1
SCHEMBL19632319 0.74 GPR119 (0.37) MAP4K4GPR119SETD7HSD11B1HDAC1
SCHEMBL22615358 0.74 MEN1 (0.39) MAP4K4GPR119SETD7HSD11B1HDAC1
SCHEMBL17925539 0.74 HDAC1 (0.39) MAP4K4GPR119SETD7HSD11B1HDAC1

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-2018011163-A1 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE AND 6,7-DIHYDRO-4H-TRIAZOLO[1,5-A]PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2018-01-18 — — WO disclosed
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