SCHEMBL3266735

SCHEMBL3266735

CC(c1ccccc1)[C@@H](N)C(=O)ONN(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
DPP4 P27487 2/20 0.41
PRCP P42785 4/20 0.39
ALOX5 P09917 1/20 0.38
MTOR P42345 1/20 0.38
AOC3 Q16853 1/20 0.37
TARS1 P26639 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
GAA P10253 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL3266529 0.81 KMT2A (0.40) KMT2AALOX5MTORCYP3A4CYP2D6
SCHEMBL6166986 0.80 KMT2A (0.58) KMT2ADPP4PRCPCYP3A4CYP1A2
SCHEMBL20543782 0.74 MMP8 (0.51) KMT2ADPP4GAATSHR
SCHEMBL3266731 0.74 ALOX5 (0.49) DPP4ALOX5AOC3GAACYP2D6
SCHEMBL31263046 0.74 DPP4 (0.47) DPP4ALOX5AOC3DPP7GAA
SCHEMBL24156377 0.73 DPP4 (0.51) DPP4ALOX5CYP2D6MAPK1
SCHEMBL8882516 0.73 DPP4 (0.51) DPP4ALOX5CYP2D6MAPK1
SCHEMBL383452 0.73 DPP4 (0.51) DPP4ALOX5CYP2D6MAPK1
SCHEMBL383451 0.73 DPP4 (0.51) DPP4ALOX5CYP2D6MAPK1
SCHEMBL180086 0.73 DPP4 (0.51) DPP4ALOX5CYP2D6MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1506969-B1 Compounds with growth hormone releasing properties HELSINN THERAPEUTICS US INC (US) 2010-06-09 EP disclosed
EP-1506969-A1 Compounds with growth hormone releasing properties NOVO NORDISK A/S (DK) 2005-02-16 EP disclosed
EP-1047709-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2004-11-03 EP disclosed
WO-1999036431-A9 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2000-07-27 WO disclosed
US-6083908-A TREATING MEDICAL DISORDERS RESULTING FROM DEFICIENCY IN GROWTH HORMONE NOVO NORDISK A/S (DK) 2000-07-04 US disclosed