SCHEMBL30173654

SCHEMBL30173654

CC(C)(C)OC(=O)N1CCN(c2ncc(F)c(C(=O)O)n2)CC1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.57
PTPN11 Q06124 1/20 0.53
ACHE P22303 2/20 0.50
MAPT P10636 1/20 0.49
CKS1B P61024 2/20 0.49
SKP1 P63208 2/20 0.49
SKP2 Q13309 2/20 0.49
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ALK Q9UM73 1/20 0.43
CHRNA7 P36544 1/20 0.43

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
SCHEMBL25279682 1.00 GPR119 (0.57) GPR119PTPN11ACHEMAPTCKS1B
SCHEMBL30892122 0.87 PTPN11 (0.60) GPR119PTPN11ACHEMAPTCKS1B
SCHEMBL20234570 0.87 PTPN11 (0.60) GPR119PTPN11ACHEMAPTCKS1B
SCHEMBL31229071 0.86 GPR119 (0.56) GPR119PTPN11ACHEMAPTCKS1B
SCHEMBL25278635 0.86 GPR119 (0.56) GPR119PTPN11ACHEMAPTCKS1B
SCHEMBL25239083 0.86 ALDH1A1 (0.62) GPR119PTPN11ACHEMAPTCKS1B
SCHEMBL30173624 0.86 ALDH1A1 (0.62) GPR119PTPN11ACHEMAPTCKS1B
SCHEMBL25274946 0.85 GPR119 (0.55) GPR119PTPN11ACHEMAPTCKS1B
SCHEMBL30166221 0.85 GPR119 (0.55) GPR119PTPN11ACHEMAPTCKS1B
SCHEMBL25233306 0.85 GPR119 (0.54) GPR119PTPN11ACHEMAPTCKS1B

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
CN-115697972-B Receptor-interacting protein 1 inhibitors including piperazine heterocyclic amide urea 维泰瑞隆有限公司 2024-11-22 CN disclosed
CN-115697972-A Receptor-interacting protein 1 inhibitors comprising piperazine heterocyclic amide ureas 维泰瑞隆有限公司 2023-02-03 CN disclosed