SCHEMBL7995758

SCHEMBL7995758

COC(=O)c1cncn1Cc1cccc(SCCOC(=O)Nc2ccccc2)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
MAPT P10636 3/20 0.43
NPSR1 Q6W5P4 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.43
GAA P10253 1/20 0.41
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
HPGD P15428 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
POLB P06746 2/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TP53 P04637 1/20 0.36
CHRNA7 P36544 1/20 0.36
MAPK1 P28482 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35

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
SCHEMBL7994278 0.81 LMNA (0.43) LMNASMN1; SMN2MAPTNPSR1L3MBTL1
SCHEMBL7997632 0.81 SMN1; SMN2 (0.44) LMNASMN1; SMN2MAPTNPSR1L3MBTL1
SCHEMBL7997644 0.81 LMNA (0.44) LMNASMN1; SMN2MAPTNPSR1L3MBTL1
SCHEMBL7997378 0.81 LMNA (0.41) LMNASMN1; SMN2MAPTNPSR1L3MBTL1
SCHEMBL7997738 0.81 LMNA (0.41) LMNASMN1; SMN2MAPTNPSR1L3MBTL1
SCHEMBL7995873 0.81 LMNA (0.45) LMNASMN1; SMN2MAPTNPSR1L3MBTL1
SCHEMBL7994274 0.81 LMNA (0.46) LMNASMN1; SMN2MAPTNPSR1L3MBTL1
SCHEMBL7996728 0.80 LMNA (0.42) LMNASMN1; SMN2MAPTNPSR1L3MBTL1
SCHEMBL7997882 0.80 LMNA (0.43) LMNASMN1; SMN2MAPTNPSR1L3MBTL1
SCHEMBL7997629 0.79 LMNA (0.47) LMNASMN1; SMN2MAPTNPSR1L3MBTL1

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
WO-2001034578-A1 COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY ASTRAZENECA AB (SE) 2001-05-17 WO claimed
WO-2001034578-A1 COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY ASTRAZENECA AB (SE) 2001-05-17 WO disclosed