SCHEMBL10036404

SCHEMBL10036404

CCOC(=O)CN1CCN(c2ccc(N)cc2F)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.51
MAPT P10636 9/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 5/20 0.48
LMNA P02545 2/20 0.48
MAPK1 P28482 2/20 0.48
GFER P55789 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
NPC1 O15118 1/20 0.47
HPGD P15428 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GAA P10253 1/20 0.47
RAD52 P43351 1/20 0.47
KDM4E B2RXH2 1/20 0.46
BACE1 P56817 1/20 0.44
CYP1A2 P05177 1/20 0.44

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
SCHEMBL29772135 0.89 L3MBTL1 (0.42) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL15764136 0.88 L3MBTL1 (0.53) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL29772091 0.88 L3MBTL1 (0.41) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL29772099 0.86 L3MBTL1 (0.41) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL29772064 0.86 HTR4 (0.42) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL12309991 0.85 L3MBTL1 (0.51) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL29772086 0.84 HCRTR2 (0.41) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL28933806 0.84 L3MBTL1 (0.71) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL12125970 0.83 L3MBTL1 (0.49) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL13419681 0.83 MAPT (0.54) L3MBTL1MAPTALDH1A1LMNAMAPK1

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-2012053606-A1 ARYLAMINOHETEROCYCLIC CARBOXAMIDE COMPOUND アステラス製薬株式会社 (JP) 2012-04-26 WO disclosed