SCHEMBL6936067

SCHEMBL6936067

CN1CCN(C(=O)OC(C)(C)C)[C@H](Cc2ccccc2)C1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 1/20 0.54
PLA2G5 P39877 1/20 0.54
KLK7 P49862 8/20 0.52
NR1H2 P55055 2/20 0.49
NR1H3 Q13133 2/20 0.49
KLK5 Q9Y337 7/20 0.47
PRSS1 P07477 3/20 0.47
PRSS2 P07478 3/20 0.47
PRSS3 P35030 3/20 0.47
PSEN1 P49768 1/20 0.44
PSEN2 P49810 1/20 0.44
APH1B Q8WW43 1/20 0.44
NCSTN Q92542 1/20 0.44
APH1A Q96BI3 1/20 0.44
PSENEN Q9NZ42 1/20 0.44
STS P08842 1/20 0.44
DPP4 P27487 1/20 0.43
GPR119 Q8TDV5 1/20 0.42
PARP1 P09874 1/20 0.42
MEN1 O00255 1/20 0.41

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
Acetic Acid SCHEMBL11078874 0.88 PLA2G10 (0.43) PLA2G10PLA2G5KLK7NR1H2NR1H3
SCHEMBL11084132 0.85 ITGB3 (0.52) PLA2G10PLA2G5KLK7NR1H2NR1H3
Hydrochloric Acid SCHEMBL6022912 0.83 PLA2G10 (0.46) PLA2G10PLA2G5KLK7NR1H2NR1H3
SCHEMBL29997797 0.82 KLK7 (0.51) PLA2G10PLA2G5KLK7NR1H2NR1H3
SCHEMBL11077466 0.82 PLA2G10 (0.52) PLA2G10PLA2G5KLK7NR1H2NR1H3
SCHEMBL23459281 0.82 NR1H2 (0.53) PLA2G10PLA2G5KLK7NR1H2NR1H3
SCHEMBL28974763 0.81 NR1H2 (0.46) PLA2G10PLA2G5KLK7NR1H2NR1H3
SCHEMBL28974779 0.81 NR1H2 (0.44) PLA2G10PLA2G5KLK7NR1H2NR1H3
SCHEMBL973127 0.81 KLK7 (0.49) PLA2G10PLA2G5KLK7NR1H2NR1H3
SCHEMBL24723803 0.80 KLK7 (0.53) PLA2G10PLA2G5KLK7NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0907643-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2003-01-15 EP disclosed
US-5919777-A PIPERAZINE DERIVATIVES USEFUL FOR TREATING MEDICAL DISORDERS RESULTING FROM A GROWTH HORMONE DEFIENCY NOVO NORDISK A/S (DK) 1999-07-06 US disclosed
EP-0907643-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1999-04-14 EP disclosed
WO-1997040023-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1997-10-30 WO disclosed