SCHEMBL11042895

SCHEMBL11042895

COC1CCC(C)(NC(N)=O)CC1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.40
MAPK8 P45983 5/20 0.33
MAPK9 P45984 1/20 0.33
DPP4 P27487 2/20 0.33
PARP1 P09874 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
Hydrochloric Acid SCHEMBL2070161 0.81 EPHX2 (0.36) EPHX2DPP4
SCHEMBL16323153 0.77
SCHEMBL12852806 0.74 DPP4 (0.33) EPHX2DPP4
SCHEMBL11733763 0.73 ALDH1A1 (0.44) DPP4TDP1
SCHEMBL27315296 0.72 DPP4 (0.43) DPP4
SCHEMBL24339641 0.71 SLC6A4 (0.35) DPP4
SCHEMBL11737698 0.71 ALDH1A1 (0.47) DPP4TDP1
SCHEMBL19696494 0.71 FFAR3 (0.36) EPHX2DPP4TDP1
SCHEMBL30536966 0.71 DPP4 (0.35) EPHX2DPP4PARP1TDP1
SCHEMBL6822953 0.70

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-4428923-A Continuous process for the production of hydrogen peroxide according to the anthraquinone process DEGUSSA AKTIENGESELLSCHAFT (DE) 1984-01-31 US disclosed