SCHEMBL8690882

SCHEMBL8690882

COc1ccccc1Cn1cc(C=O)c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.65
ALDH1A1 P00352 11/20 0.65
SMN1; SMN2 Q16637 7/20 0.65
HTT P42858 4/20 0.65
MAPT P10636 3/20 0.64
NPC1 O15118 1/20 0.64
RAB9A P51151 1/20 0.64
LMNA P02545 5/20 0.60
POLB P06746 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
TP53 P04637 1/20 0.53
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50

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
SCHEMBL8685381 0.84 ALDH1A1 (0.56) TDP1ALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL28467331 0.82 ALDH1A1 (0.70) TDP1ALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL28480601 0.81 TDP1 (0.58) TDP1ALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL27707843 0.80 TP53 (0.63) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL31542001 0.79 TDP1 (1.00) TDP1ALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL28527982 0.79 ALDH1A1 (0.70) TDP1ALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL30487286 0.79 ALDH1A1 (1.00) TDP1ALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL30487282 0.79 SMN1; SMN2 (0.72) TDP1ALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL6705979 0.79 SMN1; SMN2 (0.72) TDP1ALDH1A1SMN1; SMN2HTTMAPT
SCHEMBL4357272 0.79 ALDH1A1 (1.00) TDP1ALDH1A1SMN1; SMN2HTTMAPT

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
US-5811439-A ANTIDIABETIC AGENTS; SIDE EFFECT REDUCTION; ANTILEPEMIC AGENTS SENGA PHARMACEUTICAL LABORATORY INC. (JP) 1998-09-22 US disclosed
EP-0780389-A1 Thiazolidinedione derivatives, process for their preparation and pharmaceutical compositions containing them TOBISHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP disclosed