SCHEMBL8308748

SCHEMBL8308748

C=C1CC(C(=O)OCC)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
TSHR P16473 1/20 0.48
MAPT P10636 2/20 0.43
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 2/20 0.40
LGMN Q99538 1/20 0.39

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
SCHEMBL2160440 0.85 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1TSHRMAPT
SCHEMBL2770672 0.85 SMN1; SMN2 (0.42) ALDH1A1KMT2A
SCHEMBL30280812 0.78 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1TSHR
SCHEMBL337418 0.77 ALDH1A1 (0.65) ALDH1A1KMT2AMEN1TSHRMAPT
SCHEMBL3543973 0.76 MEN1 (0.45) ALDH1A1KMT2AMEN1TSHRMAPT
SCHEMBL8263558 0.75 ALDH1A1 (0.59) ALDH1A1KMT2AMEN1TSHRMAPT
SCHEMBL3787646 0.75 ALDH1A1 (0.59) ALDH1A1KMT2AMEN1TSHRMAPT
SCHEMBL8179660 0.75 ALDH1A1 (0.59) ALDH1A1KMT2AMEN1TSHRMAPT
SCHEMBL7311960 0.75 SMN1; SMN2 (0.50) KMT2AMEN1HTT
SCHEMBL31045711 0.73 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1TSHRMAPT

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
CN-103380131-A Heteroaryl compounds as 5-ht4 receptor ligands SUVEN LIFE SCIENCES LTD 2013-10-30 CN disclosed
CN-101252929-A G protein-coupled receptor agonists PROSIDION LTD (GB) 2008-08-27 CN disclosed
EP-0925299-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-06-30 EP disclosed
WO-1998003507-A1 PYRAZOLOPYRIDINE COMPOUND AND PHARMACEUTICAL USE THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-29 WO disclosed