SCHEMBL3268086

SCHEMBL3268086

CN(C(=O)OC(C)(C)C)[C@H](Cc1ccccc1)C(=O)N1CCC(=O)N1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 2/20 0.41
REN P00797 1/20 0.40
GAA P10253 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
AKT1 P31749 1/20 0.38
MMP13 P45452 1/20 0.37
ATM Q13315 1/20 0.36
ITGA4 P13612 1/20 0.36
ITGB7 P26010 1/20 0.36
KMT2A Q03164 1/20 0.36
P2RX7 Q99572 1/20 0.36
MAPK1 P28482 1/20 0.35
CTSS P25774 2/20 0.35
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35
CTSK P43235 1/20 0.35

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
SCHEMBL8190588 0.89 GHSR (0.40) ADORA1RENCTSSCTSBCTSK
SCHEMBL3272697 0.89 GHSR (0.40) ADORA1RENCTSSCTSBCTSK
SCHEMBL1401042 0.77 MMP13 (0.46) RENALDH1A1MAPTMMP13ATM
SCHEMBL2476924 0.77 MMP13 (0.46) RENALDH1A1MAPTMMP13ATM
SCHEMBL65502 0.77 MMP13 (0.46) RENALDH1A1MAPTMMP13ATM
SCHEMBL8164713 0.76 REN (0.48) RENALDH1A1MAPTAKT1MMP13
SCHEMBL1401166 0.75 KMT2A (0.44) ADORA1KMT2AP2RX7MAPK1
SCHEMBL5746277 0.75 ALDH1A1 (0.47) ADORA1ALDH1A1KMT2AP2RX7MAPK1
SCHEMBL5746272 0.75 ALDH1A1 (0.47) ADORA1ALDH1A1KMT2AP2RX7MAPK1
SCHEMBL11358027 0.75 REN (0.45) RENALDH1A1MAPTMMP13ATM

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 7 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
EP-1047709-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 2000-11-02 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
WO-1999036431-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1999-07-22 WO disclosed