SCHEMBL7713828

SCHEMBL7713828

NC(=O)C(=O)NCCCCCCO

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
GAA P10253 1/20 0.44
CA1 P00915 3/20 0.43
CA2 P00918 3/20 0.43
CA12 O43570 2/20 0.43
CA9 Q16790 2/20 0.43
EPHX1 P07099 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 1/20 0.41
HIF1A Q16665 1/20 0.41
EPHX2 P34913 2/20 0.40
NAAA Q02083 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACHE P22303 6/20 0.39
PAOX Q6QHF9 1/20 0.39

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
SCHEMBL28412243 1.00 TDP1 (0.46) TDP1GAACA1CA2CA12
SCHEMBL16295389 1.00 TDP1 (0.46) TDP1GAACA1CA2CA12
SCHEMBL28418917 0.98 GAA (0.46) TDP1GAACA1CA2CA12
SCHEMBL4697573 0.91 GAA (0.47) TDP1GAACA1CA2CA12
SCHEMBL20958647 0.89 CNR1 (0.48) EPHX2
SCHEMBL15201198 0.88 GAA (0.52) GAACA1CA2CA12CA9
SCHEMBL10774227 0.85 TDP1 (0.52) TDP1CA1CA2CA12CA9
SCHEMBL2746055 0.84 TDP1 (0.49) TDP1CA1CA2CA12CA9
SCHEMBL2746778 0.84 TDP1 (0.49) TDP1CA1CA2CA12CA9
SCHEMBL9765342 0.83 GAA (0.52) GAACA1CA2CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112126203-B Rapid crystallization polyester material and preparation method and application thereof 江南大学 2022-02-15 CN disclosed
CN-111349233-B Biodegradable alternating aliphatic polyester amide and preparation method thereof 东华大学 2021-10-26 CN disclosed
CN-112126203-A Rapid crystallization polyester material and preparation method and application thereof 江南大学 2020-12-25 CN disclosed
CN-111349233-A Biodegradable alternating aliphatic polyester amide and preparation method thereof 东华大学 2020-06-30 CN disclosed
US-6365172-B1 SELF-REINFORCED BIOABSORBABLE DEVICE COMPRISED OF FUSED OR SINTERED FIBERS MADE FROM BIOABSORBABLE POLYMER COMPRISING SPECIFIED POLYESTERAMIDE BIOAMIDE, INC. 2002-04-02 US disclosed