SCHEMBL29029935

SCHEMBL29029935

CC(C)(C)OC(=O)N1CCN(c2cnc(C3CC3)cn2)CC1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.56
CKS1B P61024 2/20 0.54
SKP1 P63208 2/20 0.54
SKP2 Q13309 2/20 0.54
DDB1 Q16531 1/20 0.53
CRBN Q96SW2 1/20 0.53
MAP4K4 O95819 1/20 0.47

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
SCHEMBL30395474 1.00 GPR119 (0.56) GPR119CKS1BSKP1SKP2DDB1
SCHEMBL25195768 0.88 GPR119 (0.57) GPR119CKS1BSKP1SKP2DDB1
SCHEMBL14614610 0.83 CKS1B (0.59) GPR119CKS1BSKP1SKP2DDB1
SCHEMBL25197136 0.83 GPR119 (0.55) GPR119
SCHEMBL2366254 0.81 DDB1 (0.59) GPR119CKS1BSKP1SKP2DDB1
SCHEMBL1995627 0.81 CKS1B (0.57) GPR119CKS1BSKP1SKP2DDB1
SCHEMBL1873796 0.81 CKS1B (0.57) GPR119CKS1BSKP1SKP2DDB1
SCHEMBL4724234 0.81 CKS1B (0.57) GPR119CKS1BSKP1SKP2DDB1
SCHEMBL30376692 0.81 CKS1B (0.57) GPR119CKS1BSKP1SKP2DDB1
SCHEMBL3294544 0.81 CKS1B (0.57) GPR119CKS1BSKP1SKP2DDB1

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-116157396-A Pyridazinone derivatives and their use in medicine 成都百裕制药股份有限公司 2023-05-23 CN disclosed
WO-2022111700-A1 PYRIDAZINONE DERIVATIVES AND USE THEREOF IN MEDICINE 成都百裕制药股份有限公司 2022-06-02 WO disclosed