SCHEMBL23640644

SCHEMBL23640644

COC(=O)CCc1ccnc(N2CCN(C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.48
ACHE P22303 2/20 0.48
WNT3A P56704 2/20 0.47
CKS1B P61024 2/20 0.45
SKP1 P63208 2/20 0.45
SKP2 Q13309 2/20 0.45
LRRK2 Q5S007 1/20 0.45
HRH3 Q9Y5N1 2/20 0.44
MAP4K4 O95819 1/20 0.44
TBK1 Q9UHD2 1/20 0.43
MEN1 O00255 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
AOC3 Q16853 1/20 0.42

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
SCHEMBL29943889 1.00 GPR119 (0.48) GPR119ACHEWNT3ACKS1BSKP1
SCHEMBL23630514 0.85 ALDH1A1 (0.46) HRH3KMT2ASMN1; SMN2AOC3
SCHEMBL23630504 0.80 AOC3 (0.60) HRH3MEN1KMT2AAOC3
SCHEMBL15228419 0.79 GPR119 (0.56) GPR119ACHECKS1BSKP1SKP2
Hydrochloric Acid SCHEMBL29943877 0.79 AOC3 (0.59) HRH3MEN1KMT2AAOC3
SCHEMBL20938625 0.79 HRH3 (0.59) GPR119ACHEWNT3ACKS1BSKP1
Hydrochloric Acid SCHEMBL23630339 0.79 AOC3 (0.59) HRH3MEN1KMT2AAOC3
SCHEMBL30546118 0.78 HRH3 (0.57) GPR119ACHECKS1BSKP1SKP2
SCHEMBL5682996 0.78 HRH3 (0.57) GPR119ACHECKS1BSKP1SKP2
SCHEMBL113805 0.78 GPR119 (0.55) GPR119ACHEWNT3ACKS1BSKP1

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-2021142247-A1 SMARCA2-VHL DEGRADERS AMGEN INC. (US) 2021-07-15 WO disclosed