SCHEMBL3979936

SCHEMBL3979936

O=C(O)OC1C2CCCCC21

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.32
KDM4E B2RXH2 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
EPHX1 P07099 1/20 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
SCHEMBL3983989 0.97 CES2 (0.36) POLBKDM4EL3MBTL1CES2CES1
SCHEMBL3983190 0.95 MEN1 (0.33) L3MBTL1
SCHEMBL2437352 0.77 EPHX1 (0.34) CES2CES1EPHX1
SCHEMBL3987567 0.75 NPC1 (0.33) KDM4EL3MBTL1
SCHEMBL3984069 0.73 EPHX1 (0.31) EPHX1
SCHEMBL933668 0.73 CA1 (0.31)
SCHEMBL8644323 0.73 CA1 (0.31)
SCHEMBL1554143 0.73 CA1 (0.31)
SCHEMBL2936710 0.73 CA1 (0.31)
SCHEMBL8932121 0.73 CA1 (0.31)

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
EP-1562575-B1 FUSED CYCLOALKYL AMIDES AND ACIDS AND THEIR THERAPEUTIC APPLICATIONS FOR THE TREATMENT OF I.A. EPILEPSY ABBOTT LAB (US) 2009-05-20 EP claimed