SCHEMBL7963994

SCHEMBL7963994

Cc1c(CCl)cccc1SCCOC(=O)Nc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.50
TSHR P16473 2/20 0.50
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 6/20 0.49
NPSR1 Q6W5P4 3/20 0.48
MAPT P10636 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
GAA P10253 1/20 0.47
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
RECQL P46063 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.42
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL8001444 0.89 LMNA (0.51) LMNATSHRALDH1A1SMN1; SMN2NPSR1
SCHEMBL7975290 0.83 LMNA (0.50) LMNATSHRALDH1A1SMN1; SMN2NPSR1
SCHEMBL7977628 0.82 LMNA (0.47) LMNATSHRALDH1A1SMN1; SMN2NPSR1
SCHEMBL7997629 0.82 LMNA (0.47) LMNATSHRALDH1A1SMN1; SMN2NPSR1
SCHEMBL7974463 0.81 LMNA (0.46) LMNATSHRALDH1A1SMN1; SMN2NPSR1
SCHEMBL7994118 0.81 ALDH1A1 (0.46) LMNATSHRALDH1A1SMN1; SMN2NPSR1
SCHEMBL7997644 0.80 LMNA (0.44) LMNATSHRALDH1A1SMN1; SMN2NPSR1
SCHEMBL7995873 0.80 LMNA (0.45) LMNATSHRALDH1A1SMN1; SMN2NPSR1
SCHEMBL7994549 0.80 LMNA (0.45) LMNATSHRALDH1A1SMN1; SMN2NPSR1
SCHEMBL7994274 0.80 LMNA (0.46) LMNATSHRALDH1A1SMN1; SMN2NPSR1

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-2001034573-A1 COMPOUNDS ASTRAZENECA AB (SE) 2001-05-17 WO disclosed
WO-2001034578-A1 COMPOUNDS WITH ANTI-HELICOBACTER PYLORI ACTIVITY ASTRAZENECA AB (SE) 2001-05-17 WO disclosed