SCHEMBL17790887

SCHEMBL17790887

CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCSSC(C)(C)[C@@H](CO)NC(=O)c1cccnc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SREBF2 Q12772 1/20 0.56
▸ CNR1 P21554 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ RAB9A P51151 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ALOX12 P18054 1/20 0.36
▸ FAAH O00519 3/20 0.36
▸ CNR2 P34972 2/20 0.36
▸ THRB P10828 1/20 0.35
▸ EPHX2 P34913 1/20 0.35
▸ PTAFR P25105 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HDAC3 O15379 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34

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
SCHEMBL19328425 1.00 SREBF2 (0.56) SREBF2CNR1ALDH1A1RAB9ANPC1
SCHEMBL21644810 0.93 SREBF2 (0.55) SREBF2CNR1ALDH1A1RAB9ANPC1
SCHEMBL17791033 0.93 SREBF2 (0.55) SREBF2CNR1ALDH1A1RAB9ANPC1
SCHEMBL21644809 0.92 SREBF2 (0.51) SREBF2CNR1ALDH1A1RAB9ANPC1
SCHEMBL17790728 0.92 SREBF2 (0.51) SREBF2CNR1ALDH1A1RAB9ANPC1
SCHEMBL19328481 0.92 SREBF2 (0.51) SREBF2CNR1ALDH1A1RAB9ANPC1
SCHEMBL17790874 0.92 SREBF2 (0.51) SREBF2CNR1ALDH1A1RAB9ANPC1
SCHEMBL19328468 0.92 SREBF2 (0.51) SREBF2CNR1ALDH1A1RAB9ANPC1
SCHEMBL17790823 0.92 SREBF2 (0.51) SREBF2CNR1ALDH1A1RAB9ANPC1
SCHEMBL19328539 0.91 SREBF2 (0.54) SREBF2CNR1ALDH1A1RAB9ANPC1

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 7 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-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-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-20170258741-A1 FATTY ACID CYSTEAMINE CONJUGATES AND THEIR USE AS ACTIVATORS OF AUTOPHAGY CATABASIS PHARMACEUTICALS, INC. (US) 2017-09-14 — — US disclosed
WO-2016086103-A1 FATTY ACID CYSTEAMINE CONJUGATES AND THEIR USE AS ACTIVATORS OF AUTOPHAGY CATABASIS PHARMACEUTICALS, INC. (US) 2016-06-02 — — WO 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 (3 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-20170258741-A1 FATTY ACID CYSTEAMINE CONJUGATES AND THEIR USE AS ACTIVATORS OF AUTOPHAGY NDUFAB1, ATG7, HADHA SREBF2 1632/4885CNR1 2351/4885ALDH1A1 1342/4885
US-10251845-B2 Fatty acid cysteamine conjugates and their use as activators of autophagy NDUFAB1, ATG7, NLN SREBF2 1573/4885CNR1 2707/4885ALDH1A1 1672/4885
US-20200038342-A1 FATTY ACID CYSTEAMINE CONJUGATES AND THEIR USE AS ACTIVATORS OF AUTOPHAGY ATG7, ATG4A, SLC27A1 SREBF2 408/4885CNR1 1147/4885ALDH1A1 2685/4885

“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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