SCHEMBL9658671

SCHEMBL9658671

CCCCC(CC)CN1CCC[C@H]1C(=O)OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.38
PEPD P12955 1/20 0.38
FKBP1A P62942 2/20 0.38
NR1I2 O75469 1/20 0.37
IDO1 P14902 1/20 0.37
POLB P06746 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
CA2 P00918 2/20 0.36
CA1 P00915 1/20 0.36
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
ATM Q13315 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
F2 P00734 1/20 0.35
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
MMP14 P50281 1/20 0.34
DPP4 P27487 1/20 0.34

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
SCHEMBL21340469 0.92 LTA4H (0.40) LTA4HPEPDFKBP1ANR1I2IDO1
SCHEMBL9803063 0.85 ACE (0.40) LTA4HPEPDMAPTCA2F2
SCHEMBL9803068 0.85 ACE (0.40) LTA4HPEPDMAPTCA2F2
SCHEMBL15434618 0.79 NR1I2 (0.54) LTA4HFKBP1ANR1I2POLBMAPT
SCHEMBL14115082 0.79 NR1I2 (0.54) LTA4HFKBP1ANR1I2POLBMAPT
SCHEMBL29020295 0.77 NR1I2 (0.50) LTA4HFKBP1ANR1I2POLBCYP3A4
SCHEMBL12156508 0.77 LTA4H (0.44) LTA4HPEPDFKBP1AIDO1POLB
SCHEMBL9659299 0.76 NR1I2 (0.49) LTA4HFKBP1ANR1I2POLBCYP3A4
SCHEMBL15920930 0.76 NR1I2 (0.49) LTA4HFKBP1ANR1I2POLBCYP3A4
SCHEMBL18831801 0.76 NR1I2 (0.49) LTA4HFKBP1ANR1I2POLBCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0309624-B1 COMPOSITION FOR ENHANCING PERCUTANEOUS ADMINISTRATION OF MEDICINE NITTO DENKO CORPORATION (JP) 1992-03-11 EP disclosed
EP-0309624-A1 Composition for enhancing percutaneous administration of medicine NITTO DENKO CORPORATION (JP) 1989-04-05 EP disclosed