SCHEMBL8094544

SCHEMBL8094544

Bc1cc(N)ccc1N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.53
SMARCA2 P51531 1/20 0.50
SMARCA4 P51532 1/20 0.50
PBRM1 Q86U86 1/20 0.50
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
MAP4K4 O95819 1/20 0.46
KIT P10721 1/20 0.43
PIK3CA P42336 3/20 0.42
GPR119 Q8TDV5 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
BACE1 P56817 1/20 0.42
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
CKS1B P61024 1/20 0.42
SKP1 P63208 1/20 0.42
SKP2 Q13309 1/20 0.42
PTPN11 Q06124 1/20 0.42

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
SCHEMBL5383294 0.85 NR1H2 (0.54) NR1H2SMARCA2SMARCA4PBRM1ALDH1A1
SCHEMBL993225 0.85 MAPT (0.55) NR1H2SMARCA2SMARCA4PBRM1ALDH1A1
SCHEMBL29508821 0.85 MAPT (0.55) NR1H2SMARCA2SMARCA4PBRM1ALDH1A1
SCHEMBL29569426 0.85 NR1H2 (0.54) NR1H2SMARCA2SMARCA4PBRM1ALDH1A1
SCHEMBL29508938 0.84 NR1H2 (0.53) NR1H2SMARCA2SMARCA4PBRM1ALDH1A1
SCHEMBL660403 0.84 NR1H2 (0.53) NR1H2SMARCA2SMARCA4PBRM1ALDH1A1
SCHEMBL447089 0.84 NR1H2 (0.53) NR1H2SMARCA2SMARCA4PBRM1ALDH1A1
SCHEMBL24992422 0.83 NR1H2 (0.52) NR1H2SMARCA2SMARCA4PBRM1ALDH1A1
SCHEMBL6807385 0.83 NR1H2 (0.52) NR1H2SMARCA2SMARCA4PBRM1ALDH1A1
SCHEMBL30890229 0.83 NR1H2 (0.52) NR1H2SMARCA2SMARCA4PBRM1ALDH1A1

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-2009010454-A2 AMIDO DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA S.A. (CH) 2009-01-22 WO disclosed