SCHEMBL28209529

SCHEMBL28209529

CCCCCC1(CC(C)C)CCCCC1=O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.35
CETP P11597 3/20 0.33
PTPN1 P18031 1/20 0.33
ACP1 P24666 1/20 0.33
CDC25B P30305 1/20 0.33
CYP19A1 P11511 3/20 0.30
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30
GRIN2C Q14957 1/20 0.30
GRIN3A Q8TCU5 1/20 0.30

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
SCHEMBL8622131 0.87 SIRT2 (0.41) SIRT2CETPPTPN1ACP1CDC25B
SCHEMBL28848014 0.86 SIRT2 (0.35) SIRT2CETP
SCHEMBL8624874 0.85 SIRT2 (0.43) SIRT2CETPPTPN1ACP1CDC25B
SCHEMBL5697005 0.83 SIRT2 (0.39) SIRT2CETPPTPN1ACP1CDC25B
SCHEMBL8623671 0.83 GRIN1 (0.33) CYP19A1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8622095 0.81 SIRT2 (0.45) SIRT2PTPN1ACP1CDC25BCYP19A1
SCHEMBL8622049 0.81 SIRT2 (0.35) SIRT2CETPPTPN1ACP1CDC25B
SCHEMBL8621156 0.80 SIRT2 (0.47) SIRT2PTPN1ACP1CDC25BCYP19A1
SCHEMBL6683846 0.79 SIRT2 (0.39) SIRT2CETPPTPN1ACP1CDC25B
SCHEMBL6909148 0.79 SIRT2 (0.49) SIRT2CETPPTPN1ACP1CDC25B

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-107922543-A Copolymer, its manufacture method, electric wire coatings resin material and electric wire 旭硝子株式会社 2018-04-17 CN disclosed