SCHEMBL25310609

SCHEMBL25310609

CC(C)(C)OC(=O)N1CC2CC(C1)N2c1ncc(C(F)(F)F)cn1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 6/20 0.49
▸ RORC P51449 1/20 0.41
▸ LIPE Q05469 1/20 0.40
▸ NR1H2 P55055 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ STS P08842 1/20 0.39
▸ TACR1 P25103 2/20 0.38
▸ HSD11B1 P28845 1/20 0.38
▸ SCN9A Q15858 1/20 0.38
▸ EIF2AK4 Q9P2K8 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ PIK3R1 P27986 1/20 0.37
▸ PIK3CA P42336 1/20 0.37

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
SCHEMBL24962301 0.93 GPR119 (0.57) GPR119RORCLIPEMAPTSTS
SCHEMBL31713185 0.86 GPR119 (0.57) GPR119RORCLIPEMAPTSTS
SCHEMBL30510788 0.81 GPR119 (0.58) GPR119HSD11B1
SCHEMBL25309274 0.81 GPR119 (0.52) GPR119HSD11B1EIF2AK4
SCHEMBL30859784 0.80 GPR119 (0.50) GPR119MAPT
SCHEMBL22777328 0.78 GPR119 (0.59) GPR119NR1H2PIK3R1PIK3CA
SCHEMBL21521091 0.77 GPR119 (0.60) GPR119MAPT
SCHEMBL31381882 0.77 GPR119 (0.52) GPR119
SCHEMBL31271175 0.77 GPR119 (0.58) GPR119
SCHEMBL26126417 0.77 MAPT (0.45) GPR119RORCLIPEMAPTSTS

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-2023139536-A1 (4-PIPERAZIN-1YL)-4-ALKYL-PHTHALAZIN-1(2H)-ONE COMPOUNDS AS PARP7 INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-07-27 — — WO disclosed
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