SCHEMBL30717657

SCHEMBL30717657

CC(C)(C)OC(=O)N1CC2CCC(C1)N2c1nc2c(s1)CCN(C(=O)C(F)(F)F)C2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.35
GPR119 Q8TDV5 2/20 0.35
CYP8B1 Q9UNU6 1/20 0.34
GRAMD1A Q96CP6 1/20 0.34
USP30 Q70CQ3 1/20 0.34
SPR P35270 1/20 0.33
LIPE Q05469 1/20 0.33
MAPT P10636 2/20 0.32
GCK P35557 1/20 0.32
RET P07949 1/20 0.32
HDAC4 P56524 2/20 0.32
HDAC6 Q9UBN7 2/20 0.32
FPR2 P25090 1/20 0.32
SCN4A P35499 1/20 0.32
PARP1 P09874 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PARP2 Q9UGN5 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MTOR P42345 1/20 0.32
ESR2 Q92731 1/20 0.31

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
SCHEMBL30717613 0.92 GRAMD1A (0.41) ADORA1GPR119GRAMD1AUSP30SPR
SCHEMBL30717612 0.83 ADORA1 (0.38) ADORA1GPR119USP30SPRMAPT
SCHEMBL30717569 0.80 GRAMD1A (0.39) ADORA1GPR119GRAMD1ASPRMAPT
SCHEMBL30717643 0.79 NR1H2 (0.37) ADORA1GPR119USP30LIPERET
SCHEMBL30717574 0.78 SPR (0.37) ADORA1GPR119USP30SPRRET
SCHEMBL30717629 0.77 GCK (0.43) ADORA1GRAMD1AMAPTGCKSCN4A
SCHEMBL30717602 0.77 GRAMD1A (0.38) GPR119CYP8B1GRAMD1AGCKRET
SCHEMBL30717608 0.76 DDB1 (0.37) GPR119GRAMD1AUSP30SPRRET
SCHEMBL30717625 0.75 GRAMD1A (0.44) ADORA1GPR119GRAMD1AMAPTGCK
SCHEMBL30717601 0.75 GRAMD1A (0.38) ADORA1GPR119GRAMD1ASPRGCK

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4572762-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS Mironid Limited (GB) 2025-06-25 EP disclosed
WO-2024038128-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS MIRONID LIMITED (GB) 2024-02-22 WO disclosed