SCHEMBL28519485

SCHEMBL28519485

CC(C)(C)OC(=O)N1CCC(C2CC(N3CCC[C@H]3c3ccccc3C3CC3)C2)CC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.53
NAMPT P43490 1/20 0.43
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPN6 P29350 1/20 0.42
STS P08842 1/20 0.41

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
SCHEMBL31198398 1.00 GPR119 (0.53) GPR119NAMPTJAK2JAK1PTPN2
SCHEMBL28519489 1.00 GPR119 (0.53) GPR119NAMPTJAK2JAK1PTPN2
SCHEMBL28527384 0.86 GPR119 (0.44) GPR119NAMPTSTS
SCHEMBL23578772 0.82 HRH3 (0.45) GPR119NAMPT
SCHEMBL29407322 0.82 HRH3 (0.45) GPR119NAMPT
SCHEMBL30329475 0.82 HRH3 (0.45) GPR119NAMPT
SCHEMBL29855712 0.81 GPR119 (0.40) GPR119STS
SCHEMBL26648280 0.81 GPR119 (0.40) GPR119STS
SCHEMBL24775463 0.78 GPR119 (0.50) GPR119NAMPTPTPN2PTPN1PTPN6
SCHEMBL23579324 0.76 RIPK1 (0.47) GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117683029-A Bcl-2 inhibitors 百济神州有限公司 2024-03-12 CN disclosed
CN-117430601-A Bcl-2 inhibitors 百济神州有限公司 2024-01-23 CN disclosed
CN-112437772-B Bcl-2 inhibitors 百济神州有限公司 2023-11-21 CN disclosed
CN-112437772-A Bcl-2 inhibitors 百济神州有限公司 2021-03-02 CN disclosed