SCHEMBL11095620

SCHEMBL11095620

CCN(CC)N(C(=O)C(N)CC(C)C)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LARS1 Q9P2J5 3/20 0.43
ANPEP P15144 2/20 0.42
RNPEP Q9H4A4 1/20 0.42
DNPEP Q9ULA0 1/20 0.42
SLC7A5 Q01650 1/20 0.41
ALDH1A1 P00352 2/20 0.40
GLA P06280 1/20 0.40
TSHR P16473 1/20 0.40
ELANE P08246 1/20 0.39
GPR88 Q9GZN0 1/20 0.38
LTA4H P09960 1/20 0.36
PGR P06401 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
HTR2A P28223 1/20 0.36
HRH1 P35367 1/20 0.36
KCNH2 Q12809 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL11212470 0.80 LARS1 (0.48) LARS1ANPEPRNPEPDNPEPSLC7A5
SCHEMBL16108636 0.76 CHRM2 (0.46) ANPEPRNPEPDNPEPADRA2AKCNH2
SCHEMBL8074243 0.75 GPR88 (0.44) LARS1ANPEPRNPEPDNPEPGPR88
SCHEMBL6581938 0.75 LARS1 (0.47) LARS1ANPEPRNPEPDNPEPSLC7A5
SCHEMBL8074241 0.75 GPR88 (0.44) LARS1ANPEPRNPEPDNPEPGPR88
SCHEMBL2163024 0.74 GPR88 (0.56) LARS1ALDH1A1GLATSHRGPR88
SCHEMBL27865747 0.73 ALDH1A1 (0.53) ALDH1A1GLATSHRLMNATP53
SCHEMBL851646 0.72 LARS1 (0.42) LARS1ANPEPRNPEPDNPEPSLC7A5
SCHEMBL7764387 0.72 ALDH1A1 (0.52) ALDH1A1GLATSHRLMNATP53
SCHEMBL2163674 0.72 GPR88 (0.53) LARS1ANPEPRNPEPDNPEPSLC7A5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-59227300-A None JP disclosed
JP-S59227300-A CONDENSATION REACTION AMANO PHARMACEUT CO LTD 1984-12-20 JP disclosed