SCHEMBL8066381

SCHEMBL8066381

O=C(NCC1CCNC1)NC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.84

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 17/20 0.84
EPHX2 P34913 17/20 0.84

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
SCHEMBL15172335 0.92 EPHX1 (0.71) EPHX1EPHX2
SCHEMBL8925408 0.91 EPHX2 (1.00) EPHX1EPHX2
Hydrochloric Acid SCHEMBL5144022 0.90 EPHX2 (0.97) EPHX1EPHX2
SCHEMBL4537511 0.79 EPHX1 (0.84) EPHX1EPHX2
SCHEMBL12196135 0.79 EPHX1 (1.00) EPHX1EPHX2
SCHEMBL3960013 0.77 EPHX1 (0.73) EPHX1EPHX2
SCHEMBL14101793 0.73 SLC6A1 (0.47) EPHX1EPHX2
SCHEMBL13841559 0.73 SLC6A1 (0.47) EPHX1EPHX2
SCHEMBL14365692 0.73 SLC6A1 (0.47) EPHX1EPHX2
SCHEMBL4535957 0.73 EPHX1 (1.00) EPHX1EPHX2

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
WO-2009070497-A1 SEH AND 11 β-HSD1 INHIBITORS AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2009-06-04 WO disclosed