SCHEMBL9288792

SCHEMBL9288792

COC(=O)[C@@H]1CCCN1CCCC(C)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 2/20 0.46
▸ PEPD P12955 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ NR1I2 O75469 1/20 0.39
▸ POLB P06746 2/20 0.38
▸ XPNPEP1 Q9NQW7 1/20 0.38
▸ FKBP1A P62942 2/20 0.37
▸ IDO1 P14902 1/20 0.36
▸ ADRA1D P25100 1/20 0.36
▸ ADRA1A P35348 1/20 0.36
▸ ADRA1B P35368 1/20 0.36
▸ CNR1 P21554 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ TSHR P16473 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
SCHEMBL13995210 0.84 LTA4H (0.48) LTA4HPEPDALDH1A1GAAL3MBTL1
SCHEMBL13995592 0.84 LTA4H (0.48) LTA4HPEPDALDH1A1GAAL3MBTL1
SCHEMBL19571179 0.84 LTA4H (0.48) LTA4HPEPDALDH1A1GAAL3MBTL1
SCHEMBL9284923 0.84 ACE (0.46) LTA4HPEPDNR1I2
SCHEMBL15434618 0.82 NR1I2 (0.54) LTA4HNR1I2POLBFKBP1ACYP3A4
SCHEMBL14115082 0.82 NR1I2 (0.54) LTA4HNR1I2POLBFKBP1ACYP3A4
SCHEMBL9917371 0.82 LTA4H (0.47) LTA4HPEPDALDH1A1GAAL3MBTL1
SCHEMBL7833954 0.81 LTA4H (0.48) LTA4HPEPDALDH1A1GAAL3MBTL1
SCHEMBL9921435 0.81 LTA4H (0.51) LTA4HPEPDALDH1A1GAAL3MBTL1
SCHEMBL4231027 0.81 LTA4H (0.51) LTA4HPEPDALDH1A1GAAL3MBTL1

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
US-5395916-A Glycolic acid derivative comonomer; time-release agents; drug delivery; polylactones TEIJIN LIMITED (JP) 1995-03-07 — — US disclosed
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