SCHEMBL9821183

SCHEMBL9821183

NC(=O)CNC(=O)CN1CCCCCC1=O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.58
HTT P42858 1/20 0.48
ADRA1D P25100 6/20 0.42
ADRA1A P35348 6/20 0.42
ADRA1B P35368 6/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.40
ATAD2 Q6PL18 1/20 0.40
CECR2 Q9BXF3 1/20 0.40
NQO2 P16083 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL9628927 0.94 TSHR (0.67) TSHRHTTADRA1DADRA1AADRA1B
SCHEMBL11105997 0.91 TSHR (0.63) TSHRHTTKMT2ALMNAATAD2
SCHEMBL11112926 0.91 TSHR (0.63) TSHRHTTKMT2ALMNAATAD2
SCHEMBL11110025 0.91 TSHR (0.63) TSHRHTTKMT2ALMNAATAD2
SCHEMBL21389251 0.84 HTT (0.54) TSHRHTTADRA1DADRA1AADRA1B
SCHEMBL1532937 0.82 TSHR (0.85) TSHRHTTKMT2AL3MBTL1ALDH1A1
SCHEMBL20183073 0.81 TSHR (0.56) TSHRHTTADRA1DADRA1AADRA1B
SCHEMBL24263535 0.80 TSHR (0.89) TSHRHTTKMT2ALMNAL3MBTL1
SCHEMBL10642187 0.80 HTT (0.51) TSHRHTTADRA1DADRA1AADRA1B
SCHEMBL23847771 0.80 HTT (0.51) TSHRHTTADRA1DADRA1AADRA1B

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
US-5021568-A Lactam-1-acetic acid carbalkoxymethyl esters and method for preparing same SHIPOV ALEXANDR G (SU) 1991-06-04 US disclosed
US-4162325-A PHARMACEUTICAL ACTIVITY ON THE MNEMIC PROCESSES UCB, SOCIETE ANONYME (BE) 1979-07-24 US disclosed