SCHEMBL8777892

SCHEMBL8777892

CC(C)(C)c1cc(C(=O)Nc2cc(F)ccc2NC(=O)NC23CC4CC(CC(C4)C2)C3)cc(C(C)(C)C)c1O

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 18/20 0.48
MAPT P10636 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40

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
SCHEMBL8777901 0.87 EPHX2 (0.52) EPHX2MAPTNPSR1CNR2
SCHEMBL8777856 0.86 MAPT (0.51) EPHX2MAPTNPSR1
SCHEMBL8777963 0.79 EPHX2 (0.47) EPHX2MAPTNPSR1CNR2
SCHEMBL8777889 0.78 SIGMAR1 (0.37) MAPTCNR2
SCHEMBL8777938 0.73 EPHX2 (0.49) EPHX2MAPT
SCHEMBL4347622 0.71 EPHX2 (0.60) EPHX2MAPTNPSR1
SCHEMBL8803890 0.71 EPHX2 (0.54) EPHX2MAPTNPSR1
SCHEMBL8803889 0.71 EPHX2 (0.54) EPHX2MAPTNPSR1
SCHEMBL8804609 0.71 EPHX2 (0.54) EPHX2
SCHEMBL8804204 0.69 NPC1 (0.43) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665216-B1 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO (JP) 1997-12-29 EP disclosed
US-5576335-A TREATMENT OF HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS NISSHIN FLOUR MILLING CO., LTD. (JP) 1996-11-19 US disclosed
EP-0665216-A1 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO., LTD. (JP) 1995-08-02 EP disclosed