SCHEMBL22785136

SCHEMBL22785136

O=C(OC1CNC1)N1CCc2ccccc2C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.53
ABHD6 Q9BV23 1/20 0.52
MEN1 O00255 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51
TAAR1 Q96RJ0 1/20 0.51
KEAP1 Q14145 1/20 0.49
PRMT5 O14744 3/20 0.47
WDR77 Q9BQA1 3/20 0.47
HSD11B1 P28845 1/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.46
HPGD P15428 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HTT P42858 2/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 1/20 0.46

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
SCHEMBL416047 0.89 ABHD6 (0.48) NOTUMABHD6MEN1MAPTKMT2A
SCHEMBL417106 0.89 ABHD6 (0.48) NOTUMABHD6MEN1MAPTKMT2A
SCHEMBL14393093 0.89 ABHD6 (0.48) NOTUMABHD6MEN1MAPTKMT2A
SCHEMBL30132306 0.87 NOTUM (0.57) NOTUMABHD6MEN1MAPTKMT2A
SCHEMBL22784496 0.86 NOTUM (0.50) NOTUMABHD6MEN1MAPTKMT2A
SCHEMBL28825998 0.84 KEAP1 (0.61) NOTUMABHD6MEN1MAPTKMT2A
SCHEMBL417099 0.83 NOTUM (0.50) NOTUMABHD6MEN1MAPTKMT2A
SCHEMBL417107 0.83 NOTUM (0.50) NOTUMABHD6MEN1MAPTKMT2A
SCHEMBL22784355 0.82 NOTUM (0.55) NOTUMABHD6MEN1MAPTKMT2A
SCHEMBL23562405 0.79 ABHD6 (0.48) NOTUMABHD6MEN1MAPTKMT2A

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
WO-2020252222-A1 PROGRANULIN MODULATORS AND METHODS OF USING THE SAME ARKUDA THERAPEUTICS (US) 2020-12-17 WO disclosed