SCHEMBL5352432

SCHEMBL5352432

CCC(C)C1=NN(C(C)C)C(=O)N(c2ccc(C=O)cc2)c2cc(C)c(OC)cc21

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTH1R Q03431 2/20 0.33
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAOB P27338 1/20 0.30
NR1H3 Q13133 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL5356903 0.88 PTH1R (0.34) PTH1R
SCHEMBL5350284 0.87 PTH1R (0.39) PTH1RKDM4EGAAMAPTALDH1A1
SCHEMBL5326300 0.79 PTH1R (0.48) PTH1R
SCHEMBL5350400 0.70 PTH1R (0.51) PTH1R
SCHEMBL5363678 0.69 PTH1R (0.56) PTH1R
SCHEMBL5356818 0.69 PTH1R (0.51) PTH1R
SCHEMBL5322907 0.68 PTH1R (0.49) PTH1R
SCHEMBL5359561 0.67 PTH1R (0.46) PTH1R
SCHEMBL5344822 0.66 PTH1R (0.53) PTH1R
SCHEMBL5360369 0.65 PTH1R (0.49) PTH1R

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-2007135417-A1 BENZOTRIAZEPINONE DERIVATIVES JAMES BLACK FOUNDATION (GB) 2007-11-29 WO disclosed