SCHEMBL17738124

SCHEMBL17738124

CCOCCOCCCCC1=CC(=O)C=CC1=O

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.60
▸ BACE1 P56817 1/20 0.60
▸ ALOX5 P09917 5/20 0.36
▸ PTGS2 P35354 5/20 0.36
▸ STAT3 P40763 1/20 0.36
▸ GLS2 Q9UI32 1/20 0.36
▸ MAOA P21397 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ ERBB2 P04626 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ GAA P10253 1/20 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
SCHEMBL14586070 0.89 ACHE (0.78) ACHEBACE1ALOX5PTGS2STAT3
SCHEMBL9651750 0.84 ACHE (0.55) ACHEBACE1ALOX5PTGS2GLS2
SCHEMBL10600348 0.77 ACHE (0.52) ACHEBACE1MAOAMAOBALDH1A1
SCHEMBL14680383 0.76 ACHE (0.80) ACHEBACE1ALOX5PTGS2STAT3
SCHEMBL11018415 0.75 ACHE (1.00) ACHEBACE1ALOX5PTGS2STAT3
SCHEMBL3264783 0.75 ACHE (1.00) ACHEBACE1ALOX5PTGS2STAT3
SCHEMBL10701374 0.75 ACHE (1.00) ACHEBACE1ALOX5PTGS2STAT3
SCHEMBL10704172 0.75 ACHE (1.00) ACHEBACE1ALOX5PTGS2STAT3
SCHEMBL10702354 0.75 ACHE (1.00) ACHEBACE1ALOX5PTGS2STAT3
SCHEMBL20875697 0.75 ACHE (1.00) ACHEBACE1ALOX5PTGS2STAT3

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
US-20160130216-A1 COMPOUNDS FOR PROMOTING LIPOSOMAL AND CELLULAR ADHESION AND COMPOSITIONS AND METHODS OF USE THEREOF ORGANOLINX CORP. (CA) 2016-05-12 — — 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 (1 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-20160130216-A1 COMPOUNDS FOR PROMOTING LIPOSOMAL AND CELLULAR ADHESION AND COMPOSITIONS AND METHODS OF USE THEREOF LPAR2, SGMS2, PHOSPHO1 ACHE 2068/4885BACE1 1740/4885ALOX5 311/4885

“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.

Send feedback