SCHEMBL8844962

SCHEMBL8844962

COc1ccc(Oc2ccccc2)cc1C=NO

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.57
LMNA P02545 4/20 0.57
HTT P42858 2/20 0.57
ALDH1A1 P00352 6/20 0.55
MAPT P10636 4/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.48
GAA P10253 3/20 0.47
TTR P02766 2/20 0.47
ERN1 O75460 1/20 0.46
LTA4H P09960 1/20 0.46
KDM4E B2RXH2 3/20 0.44
GLA P06280 1/20 0.44

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
SCHEMBL8844956 1.00 HPGD (0.57) HPGDLMNAHTTALDH1A1MAPT
SCHEMBL3739640 0.84 CYP1A1 (0.56) HPGDLMNAHTTALDH1A1MAPT
SCHEMBL3739643 0.84 CYP1A1 (0.56) HPGDLMNAHTTALDH1A1MAPT
SCHEMBL8844762 0.80 ERN1 (0.59) HPGDLMNAHTTALDH1A1MAPT
SCHEMBL17391853 0.80 HPGD (0.56) HPGDLMNAHTTALDH1A1MAPT
SCHEMBL17391855 0.80 HPGD (0.56) HPGDLMNAHTTALDH1A1MAPT
SCHEMBL11646840 0.75 LTA4H (0.61) LMNAHTTALDH1A1MEN1KMT2A
SCHEMBL2160891 0.75 HPGD (0.69) HPGDLMNAHTTALDH1A1MAPT
SCHEMBL2420718 0.75 HPGD (0.69) HPGDLMNAHTTALDH1A1MAPT
SCHEMBL30210927 0.75 HPGD (0.69) HPGDLMNAHTTALDH1A1MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5602151-A ADMINISTERING TO MAMMALS TO REDUCE SERUM CHOLESTEROL LEVELS AMERICAN HOME PRODUCTS CORPORATION (US) 1997-02-11 US disclosed
US-5512565-A REDUCE CHOLESTEROL ABSORPTION IN MAMMALS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-04-30 US disclosed
US-5391571-A Cholesterol ester hydrolase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1995-02-21 US disclosed
EP-0428385-A1 Cholesterol ester hydrolase inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1991-05-22 EP disclosed