SCHEMBL3266526

SCHEMBL3266526

CN(C)N.CN[C@@H](C(=O)O)C(C)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.44
AOC3 Q16853 6/20 0.42
ALOX5 P09917 1/20 0.41
CHRM2 P08172 1/20 0.41
ADRA1A P35348 1/20 0.41
RGS12 O14924 1/20 0.41
GLA P06280 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
PKM P14618 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
ALOX12 P18054 1/20 0.41
ADRA2C P18825 1/20 0.41
NFKB1 P19838 1/20 0.41
HTR2A P28223 1/20 0.41
CYP2C19 P33261 1/20 0.41
THPO P40225 1/20 0.41
GNAI1 P63096 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
SCHEMBL31369902 0.91 MME (0.50) MMECHRM2ADRA1ARGS12GLA
SCHEMBL27555773 0.91 MME (0.50) MMECHRM2ADRA1ARGS12GLA
SCHEMBL31370476 0.91 MME (0.50) MMECHRM2ADRA1ARGS12GLA
SCHEMBL31688764 0.91 MME (0.50) MMECHRM2ADRA1ARGS12GLA
SCHEMBL27555772 0.91 MME (0.50) MMECHRM2ADRA1ARGS12GLA
SCHEMBL7368324 0.81 ALOX5 (0.44) MMEALOX5CHRM2ADRA1ARGS12
SCHEMBL3266731 0.77 ALOX5 (0.49) AOC3ALOX5CYP2D6ADRA2CKDM4E
SCHEMBL28253972 0.75 DPP4 (0.48) CHRM2ADRA1ARGS12GLACYP3A4
SCHEMBL3266529 0.75 KMT2A (0.40) MMEALOX5CHRM2ADRA1ARGS12
SCHEMBL14063482 0.74 CYP2D6 (0.46) MMECHRM2ADRA1ARGS12GLA

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