SCHEMBL28061014

SCHEMBL28061014

O=C1NCCC=C1C1CNCCO1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
HTR1A P08908 1/20 0.35

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
SCHEMBL28769496 0.74 DRD2 (0.35) DRD2DRD3HTR1A
SCHEMBL4309704 0.69 DRD2 (0.42) DRD2DRD3HTR1A
SCHEMBL983430 0.69 DRD2 (0.39) DRD2DRD3HTR1A
SCHEMBL27793747 0.68 DRD2 (0.44) DRD2DRD3HTR1A
SCHEMBL28410521 0.67 DDB1 (0.34) DRD2DRD3HTR1A
SCHEMBL655504 0.67
SCHEMBL10734855 0.65 DRD2 (0.41) DRD2DRD3HTR1A
SCHEMBL4265708 0.64 DRD2 (0.38) DRD2DRD3HTR1A
SCHEMBL913262 0.63 DRD2 (0.46) DRD2DRD3HTR1A
SCHEMBL6273399 0.63 DRD2 (0.40) DRD2DRD3HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107567447-A The dimer impurity and its minimizing technology of Eliquis 意大利合成制造有限公司 2018-01-09 CN claimed
CN-114667285-A Antiviral pyrazolopyridinone compounds 诺华股份有限公司 2022-06-24 CN disclosed
CN-107567447-A The dimer impurity and its minimizing technology of Eliquis 意大利合成制造有限公司 2018-01-09 CN disclosed
CN-104277039-B Contain the pyrazoles piperidone compounds and composition thereof and purposes that replace butynyl SUNSHINE LAKE PHARMA CO.,LTD. (CN) 2016-06-01 CN disclosed
CN-104311556-B Pyrazoles containing epoxy alkyl substituting group piperidone compounds and composition thereof and purposes SUNSHINE LAKE PHARMA CO.,LTD. (CN) 2016-06-01 CN disclosed
CN-104311558-B Pyrazoles containing hexanaphthene substituting group piperidone compounds and composition thereof and purposes SUNSHINE LAKE PHARMA CO.,LTD. (CN) 2016-06-01 CN disclosed