SCHEMBL7977572

SCHEMBL7977572

Cc1c(CSc2nc3ccccc3o2)cccc1SCCOC(=O)Nc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.50
RAB9A P51151 7/20 0.50
TSHR P16473 6/20 0.50
NPC1 O15118 5/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
L3MBTL1 Q9Y468 4/20 0.45
MAPK1 P28482 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
LMNA P02545 4/20 0.45
GAA P10253 2/20 0.45
ALDH1A1 P00352 5/20 0.45
MAPT P10636 4/20 0.45
NPSR1 Q6W5P4 2/20 0.44
TP53 P04637 2/20 0.44
HPGD P15428 2/20 0.44
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP1A2 P05177 1/20 0.43

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
SCHEMBL7980234 0.82 MAPK1 (0.46) SMN1; SMN2RAB9ATSHRNPC1L3MBTL1
SCHEMBL7974397 0.80 SMN1; SMN2 (0.50) SMN1; SMN2RAB9ATSHRNPC1KMT2A
SCHEMBL7975290 0.80 LMNA (0.50) SMN1; SMN2RAB9ATSHRNPC1MEN1
SCHEMBL7977628 0.79 LMNA (0.47) SMN1; SMN2RAB9ATSHRNPC1MEN1
SCHEMBL7974463 0.79 LMNA (0.46) SMN1; SMN2RAB9ATSHRNPC1MEN1
SCHEMBL8001444 0.78 LMNA (0.51) SMN1; SMN2RAB9ATSHRNPC1MEN1
SCHEMBL7997629 0.78 LMNA (0.47) SMN1; SMN2RAB9ATSHRNPC1MEN1
SCHEMBL7963994 0.77 LMNA (0.50) SMN1; SMN2RAB9ATSHRNPC1MEN1
SCHEMBL7977637 0.77 LMNA (0.45) SMN1; SMN2RAB9ATSHRNPC1L3MBTL1
SCHEMBL7974484 0.77 MAPT (0.45) SMN1; SMN2RAB9ATSHRNPC1MEN1

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 claimed
WO-2001034573-A1 COMPOUNDS ASTRAZENECA AB (SE) 2001-05-17 WO disclosed