SCHEMBL8958101

SCHEMBL8958101

CCCCC1=NC(C)(CC2CCCCC2)C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 10/20 0.38
HSD11B1 P28845 5/20 0.35
CTSD P07339 2/20 0.35
CYP1A2 P05177 1/20 0.35
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
MMP1 P03956 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 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
SCHEMBL8958105 1.00 BACE1 (0.38) BACE1HSD11B1CTSDCYP1A2LMNA
SCHEMBL8958111 1.00 BACE1 (0.38) BACE1HSD11B1CTSDCYP1A2LMNA
SCHEMBL8958243 0.77 BACE1 (0.34) BACE1HSD11B1GAA
SCHEMBL8958239 0.77 BACE1 (0.34) BACE1HSD11B1GAA
SCHEMBL8958235 0.77 BACE1 (0.34) BACE1HSD11B1GAA
SCHEMBL8958290 0.73 BACE1 (0.33) BACE1HSD11B1GAA
SCHEMBL8958277 0.73 BACE1 (0.33) BACE1HSD11B1GAA
SCHEMBL8958282 0.73 BACE1 (0.33) BACE1HSD11B1GAA
SCHEMBL26688941 0.70 LMNA (0.31) LMNA
SCHEMBL3484547 0.70 ALDH1A1 (0.34) MAPK1

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
US-5559233-A 3-/P-PHENYLBENZYL/IMIDAZOLONES AND PYRIMIDONES SANOFI (FR) 1996-09-24 US disclosed
US-5352788-A Angiotensin antagonist ELF SANOFI (FR) 1994-10-04 US disclosed
US-5270317-A N-substituted heterocyclic derivatives, their preparation and the pharmaceutical compositions in which they are present ELF SANOFI (FR) 1993-12-14 US disclosed