SCHEMBL25931015

SCHEMBL25931015

CC1CN(C(=O)OC(C)(C)C)CCN1c1ccc(OC2CCCCO2)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 11/20 0.44
▸ PDE4B Q07343 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ ABCB1 P08183 1/20 0.42
▸ SMARCA2 P51531 1/20 0.41
▸ SMARCA4 P51532 1/20 0.41
▸ PBRM1 Q86U86 1/20 0.41
▸ USP30 Q70CQ3 1/20 0.39
▸ ALDH1A1 P00352 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
SCHEMBL30493371 1.00 GPR119 (0.44) GPR119PDE4BLMNATP53THRB
SCHEMBL25931020 1.00 GPR119 (0.44) GPR119PDE4BLMNATP53THRB
SCHEMBL25931356 1.00 GPR119 (0.44) GPR119PDE4BLMNATP53THRB
SCHEMBL25331509 0.88 CHRM4 (0.41) LMNATP53ALDH1A1
SCHEMBL15442067 0.80 GPR119 (0.64) GPR119LMNAALDH1A1
SCHEMBL13279217 0.78 SMARCA2 (0.52) GPR119LMNATP53THRBABCB1
SCHEMBL15442285 0.78 SMARCA2 (0.52) GPR119LMNATP53THRBABCB1
SCHEMBL7364745 0.78 SMARCA2 (0.52) GPR119LMNATP53THRBABCB1
SCHEMBL652991 0.77 MEN1 (0.53) GPR119LMNASMARCA2SMARCA4PBRM1
SCHEMBL656085 0.77 MEN1 (0.53) GPR119LMNASMARCA2SMARCA4PBRM1

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-2023139199-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-07-27 — — WO disclosed
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