SCHEMBL7997629

SCHEMBL7997629

Cc1c(Cn2nc3ccccc3n2)cccc1SCCOC(=O)Nc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 2/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 5/20 0.46
MAPT P10636 3/20 0.45
NPSR1 Q6W5P4 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
POLB P06746 3/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RECQL P46063 1/20 0.38
TP53 P04637 1/20 0.38
HTT P42858 1/20 0.38
HPGD P15428 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38

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
SCHEMBL7994549 0.85 LMNA (0.45) LMNAGAATSHRALDH1A1SMN1; SMN2
SCHEMBL7983528 0.85 LMNA (0.44) LMNAGAATSHRALDH1A1SMN1; SMN2
SCHEMBL7997632 0.84 SMN1; SMN2 (0.44) LMNAGAATSHRALDH1A1SMN1; SMN2
SCHEMBL8001444 0.83 LMNA (0.51) LMNAGAATSHRALDH1A1SMN1; SMN2
SCHEMBL7997882 0.82 LMNA (0.43) LMNAGAATSHRALDH1A1SMN1; SMN2
SCHEMBL7983870 0.82 GSK3B (0.48) LMNAGAATSHRALDH1A1SMN1; SMN2
SCHEMBL7983888 0.82 LMNA (0.43) LMNAGAATSHRALDH1A1SMN1; SMN2
SCHEMBL7963994 0.82 LMNA (0.50) LMNAGAATSHRALDH1A1SMN1; SMN2
SCHEMBL7995873 0.82 LMNA (0.45) LMNAGAATSHRALDH1A1SMN1; SMN2
SCHEMBL7997710 0.82 LMNA (0.48) LMNAGAATSHRALDH1A1SMN1; SMN2

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