SCHEMBL22100264

SCHEMBL22100264

COc1ccc(-c2cc(-c3ccc4c(c3)OCO4)nc(-c3ccc4c(c3)OCO4)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.61
MAPT P10636 6/20 0.61
KDM4E B2RXH2 5/20 0.61
HPGD P15428 4/20 0.61
SMN1; SMN2 Q16637 3/20 0.61
NPC1 O15118 3/20 0.61
RAB9A P51151 3/20 0.61
CASP3 P42574 1/20 0.58
SENP7 Q9BQF6 1/20 0.58
KMT2A Q03164 4/20 0.57
MEN1 O00255 3/20 0.57
NPSR1 Q6W5P4 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
MCL1 Q07820 1/20 0.56
FLT3 P36888 1/20 0.54
PTGS2 P35354 1/20 0.53
LMNA P02545 1/20 0.53
HTT P42858 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
ADORA3 P0DMS8 3/20 0.52

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
SCHEMBL22100174 0.92 MAPT (0.62) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL22100176 0.88 MCL1 (0.52) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL6482119 0.86 ALDH1A1 (0.64) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL7859483 0.79 ADORA3 (0.61) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL22074314 0.78 L3MBTL1 (0.56) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL26613484 0.78 NPC1 (0.63) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL14095434 0.77 NPC1 (0.51) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL8001457 0.77 MAPT (0.51) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL746722 0.75 ALDH1A1 (0.56) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL14458159 0.75 PTGS2 (0.87) ALDH1A1MAPTKDM4ESMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11208371-B2 Compounds, compositions, and methods for use in treating autophagy-associated disorders BIOPHAGY INC (US) 2021-12-28 US disclosed
WO-2020131924-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR USE IN TREATING AUTOPHAGY-ASSOCIATED DISORDERS Biophagy, Inc. (US) 2020-06-25 WO disclosed
US-20200190007-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR USE IN TREATING AUTOPHAGY-ASSOCIATED DISORDERS BIOPHAGY INC (US) 2020-06-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200190007-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR USE IN TREATING AUTOPHAGY-ASSOCIATED DISORDERS BECN1, ATG7, SQSTM1 ALDH1A1 2149/4885MAPT 33/4885KDM4E 4053/4885
US-11208371-B2 Compounds, compositions, and methods for use in treating autophagy-associated disorders BECN1, ATG7, SQSTM1 ALDH1A1 2149/4885MAPT 33/4885KDM4E 4053/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.