SCHEMBL7975451

SCHEMBL7975451

COC(=O)c1cccc(NC(=O)OCCSc2cccc(CSc3nc4ccccc4[nH]3)c2C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.56
LMNA P02545 5/20 0.56
RAB9A P51151 4/20 0.56
NPC1 O15118 3/20 0.56
RECQL P46063 1/20 0.56
PRMT5 O14744 2/20 0.49
WDR77 Q9BQA1 2/20 0.49
MAPT P10636 5/20 0.46
TP53 P04637 1/20 0.46
HTT P42858 1/20 0.46
MAPK1 P28482 1/20 0.46
MPO P05164 1/20 0.46
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
HPGD P15428 1/20 0.44
NR4A1 P22736 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
AR P10275 2/20 0.42

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
SCHEMBL7974465 0.94 LMNA (0.47) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL7974397 0.90 SMN1; SMN2 (0.50) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL7977583 0.90 SMN1; SMN2 (0.50) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL7964021 0.89 LMNA (0.47) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL7977567 0.88 LMNA (0.47) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL7980362 0.87 SMN1; SMN2 (0.48) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL7963991 0.87 LMNA (0.45) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL7964043 0.87 MAPT (0.50) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL7977623 0.87 LMNA (0.55) SMN1; SMN2LMNARAB9ANPC1RECQL
SCHEMBL7975380 0.85 LMNA (0.47) SMN1; SMN2LMNARAB9ANPC1MAPT

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