SCHEMBL28859583

SCHEMBL28859583

CC(C)(c1ccccc1)C1CCCOC1=O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
ATM Q13315 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP2C9 P11712 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
NAMPT P43490 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
KIF11 P52732 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KCNH3 Q9ULD8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GAA P10253 1/20 0.32
CYP2B6 P20813 1/20 0.32
F2 P00734 2/20 0.31
PRSS1 P07477 2/20 0.31

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
SCHEMBL10784340 0.86 LMNA (0.40) LMNAATMCYP2C19SMN1; SMN2KEAP1
SCHEMBL314331 0.75 LMNA (0.38) LMNAATMSMN1; SMN2KEAP1NFE2L2
SCHEMBL12390079 0.75 FKBP1A (0.36)
SCHEMBL11467541 0.73 MCL1 (0.44) CYP2C19CYP2C9KEAP1NFE2L2ALDH1A1
SCHEMBL17914392 0.73 HDAC4 (0.31)
SCHEMBL11873477 0.72 CYP2C9 (0.38) LMNAATMCYP2C19CYP2C9KEAP1
SCHEMBL18589835 0.72 FKBP1A (0.35)
SCHEMBL9932801 0.70 ALDH1A1 (0.36) CYP2C19CYP2C9SMN1; SMN2ALDH1A1GAA
SCHEMBL362829 0.70 FKBP1A (0.39)
SCHEMBL14199593 0.69 GAA (0.39) LMNAATMCYP2C19SMN1; SMN2KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111019247-B Foaming material, preparation method thereof and foaming product 宁波长阳科技股份有限公司 2022-09-13 CN disclosed