SCHEMBL7977585

SCHEMBL7977585

Cc1c(CSc2nc3ccncc3[nH]2)cccc1SCCOC(=O)Nc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 7/20 0.48
RAB9A P51151 6/20 0.48
NPC1 O15118 4/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPT P10636 4/20 0.46
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
LMNA P02545 5/20 0.43
MAPK1 P28482 2/20 0.43
GAA P10253 2/20 0.43
HTT P42858 1/20 0.43
PKM P14618 2/20 0.43
ENPP1 P22413 1/20 0.42
TSHR P16473 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TP53 P04637 1/20 0.40

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
SCHEMBL7974397 0.91 SMN1; SMN2 (0.50) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL7974305 0.85 MAPT (0.53) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL7975380 0.84 LMNA (0.47) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL7963977 0.84 LMNA (0.49) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL7975313 0.84 LMNA (0.44) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL7964021 0.83 LMNA (0.47) POLBSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL7974465 0.83 LMNA (0.47) POLBSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL7977583 0.82 SMN1; SMN2 (0.50) POLBSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL7977567 0.82 LMNA (0.47) POLBSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL7964043 0.82 MAPT (0.50) POLBSMN1; SMN2RAB9ANPC1ALDH1A1

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