SCHEMBL10794829

SCHEMBL10794829

CCC(C)OP(=O)(O)C(=NOC(=O)COc1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.55
L3MBTL1 Q9Y468 5/20 0.49
MAPT P10636 4/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
TDP1 Q9NUW8 4/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
HTT P42858 1/20 0.40
LMNA P02545 1/20 0.39
PTGS2 P35354 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 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
SCHEMBL10800647 0.96 L3MBTL1 (0.53) SMN1; SMN2L3MBTL1MAPTKMT2AMEN1
SCHEMBL10795808 0.95 L3MBTL1 (0.52) SMN1; SMN2L3MBTL1MAPTKMT2AMEN1
SCHEMBL10795598 0.91 MAPT (0.53) SMN1; SMN2L3MBTL1MAPTKMT2AMEN1
SCHEMBL10795791 0.88 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1MAPTKMT2AMEN1
SCHEMBL10794878 0.85 SMN1; SMN2 (0.47) SMN1; SMN2L3MBTL1MAPTKMT2AMEN1
SCHEMBL10795712 0.85 MAPT (0.45) SMN1; SMN2L3MBTL1MAPTKMT2AMEN1
SCHEMBL10795441 0.85 L3MBTL1 (0.46) SMN1; SMN2L3MBTL1MAPTKMT2AMEN1
SCHEMBL10795581 0.83 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1MAPTKMT2AMEN1
SCHEMBL10795962 0.81 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1MAPTALDH1A1TDP1
SCHEMBL10811955 0.80 ALDH1A1 (0.41) SMN1; SMN2L3MBTL1MAPTKMT2AMEN1

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-4652666-A PLANT SAFENING AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-24 US disclosed