SCHEMBL8779375

SCHEMBL8779375

CC(=O)Oc1cc(C)cc(OC(C)=O)c1OC(C)=O.Nc1nnc(S)s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 3/20 0.37
POLB P06746 3/20 0.35
GAA P10253 3/20 0.35
RAB9A P51151 3/20 0.35
HTT P42858 3/20 0.35
ELANE P08246 1/20 0.35
ALDH1A1 P00352 4/20 0.34
HPGD P15428 2/20 0.34
KMT2A Q03164 4/20 0.32
MAPT P10636 3/20 0.32
RECQL P46063 3/20 0.32
BLM P54132 3/20 0.32
KDM4E B2RXH2 2/20 0.32
APEX1 P27695 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
MEN1 O00255 3/20 0.32
HSD17B10 Q99714 3/20 0.32
ALOX15 P16050 2/20 0.32
SMN1; SMN2 Q16637 3/20 0.31

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
SCHEMBL8779376 0.85 ALDH1A1 (0.41) TOP1GAARAB9AALDH1A1HPGD
SCHEMBL8779352 0.82 NR3C1 (0.44) GAARAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL8779346 0.78 LMNA (0.57) POLBRAB9AELANEALDH1A1KMT2A
SCHEMBL10053943 0.77 TOP1 (0.53) TOP1POLBGAARAB9AHTT
SCHEMBL8779305 0.76 LMNA (0.61) POLBALDH1A1KMT2AMAPTMEN1
SCHEMBL10053942 0.71 ACHE (0.54) TOP1POLBGAAHTTELANE
SCHEMBL8779330 0.70 RAB9A (0.53) POLBGAARAB9AHTTALDH1A1
SCHEMBL13775501 0.67 ACHE (0.58) POLBGAAHTTALDH1A1KMT2A
SCHEMBL94066 0.66
SCHEMBL21579506 0.65 MAPK1 (0.57) TOP1POLBGAARAB9AHTT

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
EP-0579129-B1 Thiadiazole derivatives for the treatment of depressive states CT LAB FARM SRL (IT) 1997-03-05 EP claimed