SCHEMBL1604609

SCHEMBL1604609

CCC=CCC=CCC=CCC=CCC=CCCCC(=O)NCCSSCCN

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 7/20 0.64
▸ ALDH1A1 P00352 3/20 0.52
▸ FAAH O00519 2/20 0.52
▸ CNR2 P34972 2/20 0.52
▸ TRPM8 Q7Z2W7 1/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ KCNK3 O14649 1/20 0.52
▸ BLM P54132 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ TRPV1 Q8NER1 1/20 0.52
▸ MAPT P10636 2/20 0.51
▸ HPGD P15428 1/20 0.51
▸ ALOX12 P18054 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ EPHX2 P34913 1/20 0.51

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
SCHEMBL1604608 1.00 CNR1 (0.64) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL14746491 1.00 CNR1 (0.64) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL15951429 0.95 CNR1 (0.64) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL12478623 0.93 CNR1 (0.73) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL14739244 0.92 CNR1 (0.62) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL14739242 0.92 CNR1 (0.62) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL12685101 0.91 CNR1 (0.69) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL15124270 0.90 CNR1 (0.64) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL14752452 0.89 CNR1 (0.68) CNR1ALDH1A1FAAHCNR2TRPM8
SCHEMBL14752451 0.89 CNR1 (0.68) CNR1ALDH1A1FAAHCNR2TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200038342-A1 FATTY ACID CYSTEAMINE CONJUGATES AND THEIR USE AS ACTIVATORS OF AUTOPHAGY CATABASIS PHARMACEUTICALS, INC. 2020-02-06 — — US disclosed
US-10251845-B2 Fatty acid cysteamine conjugates and their use as activators of autophagy CATABASIS PHARMACEUTICALS, INC. (US) 2019-04-09 — — US disclosed
US-20170258741-A1 FATTY ACID CYSTEAMINE CONJUGATES AND THEIR USE AS ACTIVATORS OF AUTOPHAGY CATABASIS PHARMACEUTICALS, INC. (US) 2017-09-14 — — US disclosed
US-20170073305-A1 FATTY ACID AMIDES, COMPOSITIONS AND METHODS OF USE CATABASIS PHARMACEUTICALS, INC. 2017-03-16 — — US disclosed
EP-2949344-A2 USE OF INTRACELLULAR ENZYMES FOR THE RELEASE OF COVALENTLY LINKED BIOACTIVES Catabasis Pharmaceuticals, Inc. (US) 2015-12-02 — — EP disclosed
US-20140315786-A1 USE OF INTRACELLULAR ENZYMES FOR THE RELEASE OF COVALENTLY LINKED BIOACTIVES CATABASIS PHARMACEUTICALS, INC. (US) 2014-10-23 — — US disclosed
EP-2751071-A2 FATTY ACID AMIDES, COMPOSITIONS AND METHODS OF USE Milne, Jill C. (US) 2014-07-09 — — EP disclosed
US-20130190327-A1 BIS-FATTY ACID CONJUGATES AND THEIR USES CATABASIS PHARMACEUTICALS INC (US) 2013-07-25 — — US disclosed
WO-2013033602-A2 FATTY ACID AMIDES, COMPOSITIONS AND METHODS OF USE MILNE JILL C (US) 2013-03-07 — — WO disclosed
US-20130059801-A1 FATTY ACID AMIDES, COMPOSITIONS AND METHODS OF USE CATABASIS PHARMACEUTICALS, INC. (US) 2013-03-07 — — US disclosed
US-20110082202-A1 FATTY ACID ACIFRAN DERIVATIVES AND THEIR USES CATABASIS PHARMACEUTICALS, INC. 2011-04-07 — — 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 (8 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-20130059801-A1 FATTY ACID AMIDES, COMPOSITIONS AND METHODS OF USE FASN, FADS1, ELOVL5 CNR1 1072/4885ALDH1A1 810/4885FAAH 29/4885
US-20170258741-A1 FATTY ACID CYSTEAMINE CONJUGATES AND THEIR USE AS ACTIVATORS OF AUTOPHAGY NDUFAB1, ATG7, HADHA CNR1 2351/4885ALDH1A1 1342/4885FAAH 2282/4885
US-20140315786-A1 USE OF INTRACELLULAR ENZYMES FOR THE RELEASE OF COVALENTLY LINKED BIOACTIVES GAA, GUSB, ACER2 CNR1 3616/4885ALDH1A1 1139/4885FAAH 766/4885
US-20130190327-A1 BIS-FATTY ACID CONJUGATES AND THEIR USES FASN, ELOVL1, ELOVL5 CNR1 2557/4885ALDH1A1 610/4885FAAH 124/4885
US-10251845-B2 Fatty acid cysteamine conjugates and their use as activators of autophagy NDUFAB1, ATG7, NLN CNR1 2707/4885ALDH1A1 1672/4885FAAH 2320/4885
US-20110082202-A1 FATTY ACID ACIFRAN DERIVATIVES AND THEIR USES FABP4, FASN, ELOVL6 CNR1 1599/4885ALDH1A1 936/4885FAAH 159/4885
US-20170073305-A1 FATTY ACID AMIDES, COMPOSITIONS AND METHODS OF USE FASN, FADS1, ELOVL5 CNR1 1072/4885ALDH1A1 810/4885FAAH 29/4885
US-20200038342-A1 FATTY ACID CYSTEAMINE CONJUGATES AND THEIR USE AS ACTIVATORS OF AUTOPHAGY ATG7, ATG4A, SLC27A1 CNR1 1147/4885ALDH1A1 2685/4885FAAH 193/4885

“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.

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