SCHEMBL1929935

SCHEMBL1929935

O=C(CO)Oc1ccc(-c2coc3cc(OC(=O)CO)ccc3c2=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.64
MAPT P10636 6/20 0.64
NPC1 O15118 4/20 0.64
RAB9A P51151 4/20 0.64
SMN1; SMN2 Q16637 4/20 0.64
KDM4E B2RXH2 2/20 0.64
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
MAPK1 P28482 3/20 0.63
TSHR P16473 2/20 0.63
LMNA P02545 1/20 0.63
ALDH2 P05091 11/20 0.62
MAOA P21397 6/20 0.62
MAOB P27338 6/20 0.62
TP53 P04637 2/20 0.60
HSD17B10 Q99714 2/20 0.60
XDH P47989 1/20 0.60
HDAC6 Q9UBN7 2/20 0.58
GAA P10253 2/20 0.58
POLB P06746 1/20 0.58

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
SCHEMBL15110348 0.88 ALDH2 (0.63) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL1724568 0.85 MAPT (0.85) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL554685 0.85 ALDH2 (0.67) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL5497023 0.84 ALDH2 (0.69) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL28648204 0.84 MAPT (0.76) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL16232228 0.84 ALDH2 (0.73) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL5489200 0.84 ALDH2 (0.69) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL28643838 0.83 MAPT (0.74) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL19410274 0.83 ALDH2 (0.68) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL19410269 0.83 ALDH2 (0.65) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8372882-B2 Functionalized phenolic esters and amides and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2013-02-12 US disclosed
US-8372882-B2 Functionalized phenolic esters and amides and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2013-02-12 US disclosed
US-8372882-B2 Functionalized phenolic esters and amides and polymers therefrom BEZWADA BIOMEDICAL, LLC (US) 2013-02-12 US disclosed
US-20110130448-A1 FUNCTIONALIZED PHENOLIC ESTERS AND AMIDES AND POLYMERS THEREFROM BEZWADA BIOMEDICAL LLC (US) 2011-06-02 US disclosed
US-20110130448-A1 FUNCTIONALIZED PHENOLIC ESTERS AND AMIDES AND POLYMERS THEREFROM BEZWADA BIOMEDICAL LLC (US) 2011-06-02 US disclosed
US-20110130448-A1 FUNCTIONALIZED PHENOLIC ESTERS AND AMIDES AND POLYMERS THEREFROM BEZWADA BIOMEDICAL LLC (US) 2011-06-02 US disclosed
US-7858077-B2 Functionalized phenolic esters and amides and polymers therefrom BEZWADA BIOMEDICAL LLC (US) 2010-12-28 US disclosed
US-7858077-B2 Functionalized phenolic esters and amides and polymers therefrom BEZWADA BIOMEDICAL LLC (US) 2010-12-28 US disclosed
US-7858077-B2 Functionalized phenolic esters and amides and polymers therefrom BEZWADA BIOMEDICAL LLC (US) 2010-12-28 US disclosed
US-20060173065-A1 Functionalized phenolic esters and amides and polymers therefrom BEZWADA BIOMEDICAL LLC 2006-08-03 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-20060173065-A1 Functionalized phenolic esters and amides and polymers therefrom HAAO, HAO2, HCAR3 ALDH1A1 132/4885MAPT 3480/4885NPC1 3222/4885
US-20110130448-A1 FUNCTIONALIZED PHENOLIC ESTERS AND AMIDES AND POLYMERS THEREFROM HAO2, HCAR2, HAAO ALDH1A1 137/4885MAPT 3453/4885NPC1 3136/4885

“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.