SCHEMBL27712467

SCHEMBL27712467

CC(=O)OC1(NC(=O)c2cc3ccccc3cc2N)CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.42
PYGL P06737 6/20 0.39
CYP2C9 P11712 1/20 0.39
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CTSL P07711 2/20 0.36
CTSK P43235 2/20 0.36
MAPT P10636 2/20 0.34
NPC1 O15118 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MITF O75030 1/20 0.34
GAA P10253 1/20 0.34
NCOA1 Q15788 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
TACR3 P29371 1/20 0.34
OGG1 O15527 1/20 0.33

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
SCHEMBL27712337 0.87 IDO1 (0.37) IDO1PYGLCYP2C9RAB9AL3MBTL1
SCHEMBL27692521 0.81 CTSL (0.55) RAB9ACTSLCTSKMAPTNPC1
SCHEMBL5196554 0.79 PYGL (0.46) IDO1PYGLCYP2C9RAB9AL3MBTL1
SCHEMBL5192234 0.79 PYGL (0.46) IDO1PYGLCYP2C9RAB9AL3MBTL1
SCHEMBL5194411 0.79 PYGL (0.46) IDO1PYGLCYP2C9RAB9AL3MBTL1
SCHEMBL5197354 0.79 PYGL (0.46) IDO1PYGLCYP2C9RAB9AL3MBTL1
SCHEMBL5196425 0.78 PYGL (0.45) IDO1PYGLCYP2C9RAB9AL3MBTL1
SCHEMBL5193270 0.77 PYGL (0.56) IDO1PYGLCYP2C9CTSLCTSK
SCHEMBL27712399 0.77 PYGL (0.56) IDO1PYGLCYP2C9CTSLCTSK
SCHEMBL27712418 0.76 IDO1 (0.40) IDO1PYGLCYP2C9RAB9AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101098852-A Glycogen phosphorylase inhibitor compounds and pharmaceutical compositions thereof SMITHKLINE BEECHAM CORP (US) 2008-01-02 CN disclosed