SCHEMBL6599890

SCHEMBL6599890

CCOC(=O)c1noc([C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.58
ALDH1A1 P00352 6/20 0.56
NPSR1 Q6W5P4 6/20 0.52
HPGD P15428 5/20 0.52
HTT P42858 5/20 0.52
LMNA P02545 4/20 0.52
PKM P14618 3/20 0.52
HSD17B10 Q99714 3/20 0.52
KMT2A Q03164 3/20 0.52
XBP1 P17861 2/20 0.52
MEN1 O00255 2/20 0.52
ALOX15 P16050 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MMP2 P08253 1/20 0.52
BMP1 P13497 1/20 0.52
JAK2 O60674 3/20 0.50
TP53 P04637 2/20 0.50
MAPT P10636 2/20 0.50
AGTR1 P30556 1/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL6602038 0.87 CTSS (0.54) TSHRALDH1A1MMP2BMP1CTSS
SCHEMBL6602040 0.87 CTSS (0.54) TSHRALDH1A1MMP2BMP1CTSS
SCHEMBL7222255 0.85 ALDH1A1 (0.59) TSHRALDH1A1NPSR1HPGDHTT
SCHEMBL5960981 0.85 ALDH1A1 (0.59) TSHRALDH1A1NPSR1HPGDHTT
SCHEMBL6602634 0.84 MMP2 (0.58) ALDH1A1NPSR1HPGDLMNASMN1; SMN2
SCHEMBL6605301 0.82 MMP2 (0.43) TSHRALDH1A1NPSR1HPGDHTT
SCHEMBL8905981 0.82 TSHR (0.44) TSHRALDH1A1NPSR1HPGDHTT
SCHEMBL6600848 0.82 TSHR (0.44) TSHRALDH1A1NPSR1HPGDHTT
SCHEMBL7001607 0.81 ALDH1A1 (0.57) TSHRALDH1A1NPSR1HPGDHTT
SCHEMBL4831951 0.80 ALDH1A1 (0.51) TSHRALDH1A1NPSR1HPGDHTT

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-0805816-B1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK AS (DK) 2004-07-28 EP disclosed
US-6350767-B1 GROWTH HORMONE RELEASE STIMULANT NOVO NORDISK A/S (DK) 2002-02-26 US disclosed
US-6013658-A ANIMAL GROWTH REGULATORS NOVO NORDISK A/S (DK) 2000-01-11 US disclosed
EP-0805816-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1997-11-12 EP disclosed
WO-1996022997-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1996-08-01 WO disclosed