SCHEMBL11219306

SCHEMBL11219306

CCOC(=O)C(C)=C(C)NC(=O)OCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.53
TSHR P16473 2/20 0.53
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
MAPK1 P28482 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TACR1 P25103 1/20 0.44
ALDH1A1 P00352 3/20 0.42
PTGDR2 Q9Y5Y4 2/20 0.42
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 1/20 0.40
BACE1 P56817 1/20 0.40
HPGD P15428 1/20 0.39
MAOB P27338 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
CYP4F2 P78329 1/20 0.39

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
SCHEMBL11219303 1.00 SMN1; SMN2 (0.53) SMN1; SMN2TSHRKMT2AMEN1MAPK1
SCHEMBL11234775 0.84 SMN1; SMN2 (0.47) SMN1; SMN2TSHRKMT2AMEN1MAPK1
SCHEMBL11234771 0.84 SMN1; SMN2 (0.47) SMN1; SMN2TSHRKMT2AMEN1MAPK1
SCHEMBL11220832 0.79 SMN1; SMN2 (0.52) SMN1; SMN2TSHRKMT2AMEN1MAPK1
SCHEMBL11220830 0.79 SMN1; SMN2 (0.52) SMN1; SMN2TSHRKMT2AMEN1MAPK1
SCHEMBL11227517 0.79 MEN1 (0.48) SMN1; SMN2TSHRKMT2AMEN1MAPK1
SCHEMBL11232651 0.78 MEN1 (0.47) SMN1; SMN2TSHRKMT2AMEN1MAPK1
SCHEMBL11226746 0.77 IDO1 (0.45) SMN1; SMN2TSHRPTGDR2KDM4EMAOB
SCHEMBL11229052 0.76 SMN1; SMN2 (0.51) SMN1; SMN2TSHRKMT2AMEN1MAPK1
SCHEMBL11229054 0.76 SMN1; SMN2 (0.51) SMN1; SMN2TSHRKMT2AMEN1MAPK1

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
US-4358606-A Esters of phenalkyloxycarbonylamino acids ZOECON CORPORATION (US) 1982-11-09 US disclosed