SCHEMBL26239143

SCHEMBL26239143

CC(C)(C(=O)NC1CC1)N1CCC(C#N)(c2cccc(F)c2F)CC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BDKRB1 P46663 2/20 0.42
▸ PDE4A P27815 1/20 0.40
▸ PDE4B Q07343 1/20 0.40
▸ PDE4C Q08493 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ HSD11B1 P28845 2/20 0.38
▸ SSTR4 P31391 6/20 0.38
▸ HDAC4 P56524 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ ADRA1D P25100 1/20 0.34
▸ ADRA1A P35348 1/20 0.34
▸ ADRA1B P35368 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HCRTR2 O43614 1/20 0.34

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
SCHEMBL26239138 0.86 BDKRB1 (0.40) BDKRB1PDE4APDE4BPDE4CPDE4D
SCHEMBL26239140 0.82 BDKRB1 (0.39) BDKRB1PDE4APDE4BPDE4CPDE4D
SCHEMBL25389124 0.82 ADRA1D (0.39) BDKRB1PDE4APDE4BPDE4CPDE4D
SCHEMBL26239136 0.80 LMNA (0.41) BDKRB1PDE4APDE4BPDE4CPDE4D
SCHEMBL26238626 0.74 HSD11B1 (0.45) HSD11B1SSTR4SIGMAR1ADRA1DADRA1A
SCHEMBL25388886 0.74 GPR119 (0.43) BDKRB1KMT2A
SCHEMBL3868254 0.71 HDAC4 (0.42) BDKRB1HDAC4
SCHEMBL18742752 0.68 HDAC4 (0.44) BDKRB1HDAC4KMT2A
SCHEMBL5138689 0.67 HDAC4 (0.46) BDKRB1HDAC4KMT2A
SCHEMBL25464109 0.67 L3MBTL1 (0.44) SSTR4L3MBTL1KMT2A

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-2023172415-A1 SWEETENER COMPOSITIONS FIRMENICH INCORPORATED (US) 2023-09-14 — — WO disclosed
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