SCHEMBL29165352

SCHEMBL29165352

N#CC=CN1CCCC1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.35
BRD2 P25440 1/20 0.35
CHRM2 P08172 3/20 0.34
CHRM5 P08912 3/20 0.34
CHRM1 P11229 3/20 0.34
CHRM3 P20309 3/20 0.34
CYP2D6 P10635 2/20 0.34
CYP1A2 P05177 1/20 0.34
CHRM4 P08173 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PIK3CD O00329 1/20 0.33
TSHR P16473 2/20 0.32
LMNA P02545 3/20 0.32
ALDH1A1 P00352 2/20 0.32
APEX1 P27695 2/20 0.32
PMP22 Q01453 2/20 0.32
ALOX12 P18054 1/20 0.32
NFKB1 P19838 1/20 0.32
MAPK1 P28482 1/20 0.32

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
Acrylonitrile SCHEMBL1275308 0.74 ALDH1A1 (0.35) BRD4BRD2CHRM2CHRM5CHRM1
SCHEMBL10887603 0.74 BRD4 (0.41) BRD4BRD2CHRM2CHRM5CHRM1
SCHEMBL8658307 0.72
SCHEMBL195054 0.72
SCHEMBL7109892 0.72
SCHEMBL11827149 0.72
SCHEMBL19448367 0.72
SCHEMBL2877524 0.72
SCHEMBL21837110 0.72
SCHEMBL27987142 0.72

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-117673371-B Preparation method of current collector for non-negative electrode lithium metal battery, current collector and application 中节能万润股份有限公司 2024-04-30 CN claimed
CN-117673371-A Preparation method of current collector for non-negative electrode lithium metal battery, current collector and application 中节能万润股份有限公司 2024-03-08 CN claimed
CN-117673371-B Preparation method of current collector for non-negative electrode lithium metal battery, current collector and application 中节能万润股份有限公司 2024-04-30 CN disclosed
CN-117673371-B Preparation method of current collector for non-negative electrode lithium metal battery, current collector and application 中节能万润股份有限公司 2024-04-30 CN disclosed
CN-117673371-A Preparation method of current collector for non-negative electrode lithium metal battery, current collector and application 中节能万润股份有限公司 2024-03-08 CN disclosed
CN-117673371-A Preparation method of current collector for non-negative electrode lithium metal battery, current collector and application 中节能万润股份有限公司 2024-03-08 CN disclosed