SCHEMBL25685404

SCHEMBL25685404

CC(C)(C)OC(=O)NC1CCC(CCCCF)CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.47
EPHX1 P07099 2/20 0.46
KDM1A O60341 1/20 0.45
MAOB P27338 1/20 0.45
BTK Q06187 1/20 0.44
DRD3 P35462 2/20 0.44
CTSK P43235 2/20 0.42
GAA P10253 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL30199256 0.87 DRD2 (0.48) DRD2EPHX1KDM1AMAOBBTK
SCHEMBL28604444 0.85 TDP1 (0.50) DRD2EPHX1KDM1AMAOBBTK
SCHEMBL14231252 0.85 DRD2 (0.47) DRD2EPHX1KDM1AMAOBBTK
SCHEMBL19445904 0.85 DRD2 (0.49) DRD2EPHX1KDM1AMAOBBTK
SCHEMBL21482088 0.85 DRD2 (0.49) DRD2EPHX1KDM1AMAOBBTK
SCHEMBL22488855 0.85 DRD2 (0.49) DRD2EPHX1KDM1AMAOBBTK
SCHEMBL4805690 0.84 DRD2 (0.46) DRD2EPHX1KDM1AMAOBBTK
SCHEMBL4805695 0.84 DRD2 (0.46) DRD2EPHX1KDM1AMAOBBTK
SCHEMBL22489272 0.84 DRD2 (0.48) DRD2EPHX1KDM1AMAOBBTK
SCHEMBL23185506 0.83 DRD2 (0.50) DRD2EPHX1KDM1AMAOBBTK

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-2023110700-A1 DIHYDROFUROPYRIDINE DERIVATIVES AS RHO-KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2023-06-22 WO disclosed