SCHEMBL156641

SCHEMBL156641

COC(=O)c1ccccc1N1CCc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
MYC P01106 1/20 0.53
ALDH1A1 P00352 5/20 0.51
SMN1; SMN2 Q16637 3/20 0.49
NOTUM Q6P988 2/20 0.48
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
HSD17B10 Q99714 2/20 0.47
CFTR P13569 1/20 0.47
PRMT5 O14744 2/20 0.47
WDR77 Q9BQA1 2/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 2/20 0.46
PKM P14618 1/20 0.46
NFKB1 P19838 1/20 0.46
MAOB P27338 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 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
SCHEMBL19732068 0.81 MYC (0.55) MEN1KMT2AMYCALDH1A1SMN1; SMN2
SCHEMBL6715699 0.81 NPC1 (0.53) MEN1KMT2AMYCALDH1A1SMN1; SMN2
SCHEMBL22226513 0.80 HPGD (0.51) MEN1KMT2AALDH1A1SMN1; SMN2RAB9A
SCHEMBL22226470 0.80 HPGD (0.53) MEN1KMT2AALDH1A1SMN1; SMN2RAB9A
SCHEMBL30109558 0.79 PRMT5 (0.54) MEN1KMT2AMYCALDH1A1SMN1; SMN2
SCHEMBL27892679 0.78 APOBEC3A (0.55) MEN1KMT2AMYCALDH1A1SMN1; SMN2
SCHEMBL29132406 0.76 MEN1 (0.52) MEN1KMT2AALDH1A1SMN1; SMN2NOTUM
SCHEMBL5742226 0.75 MYC (0.55) MEN1KMT2AMYCALDH1A1SMN1; SMN2
SCHEMBL23708768 0.74 NPC1 (0.60) MEN1KMT2AMYCALDH1A1SMN1; SMN2
SCHEMBL11445874 0.74 ALDH1A1 (0.64) MEN1KMT2AALDH1A1SMN1; SMN2NOTUM

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
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed