SCHEMBL20819989

SCHEMBL20819989

C=CCCC(O)C(CCC=C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
ABCC4 O15439 1/20 0.34
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 3/20 0.31
DDAH1 O94760 1/20 0.31
GRIK1 P39086 2/20 0.31
GRIK2 Q13002 2/20 0.31
FAAH O00519 1/20 0.30
USP2 O75604 1/20 0.30
CYP3A4 P08684 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL22552623 1.00 MAPT (0.34) MAPTABCC4TDP1ALDH1A1DDAH1
SCHEMBL1882682 0.83 RNPEP (0.35) MAPTALDH1A1FAAHUSP2CYP3A4
SCHEMBL1882200 0.83 FAAH (0.37) MAPTABCC4ALDH1A1DDAH1FAAH
SCHEMBL15698565 0.80 TSHR (0.39) MAPTABCC4ALDH1A1DDAH1GRIK1
SCHEMBL629530 0.80 TSHR (0.39) MAPTABCC4ALDH1A1DDAH1GRIK1
SCHEMBL27696125 0.80 TSHR (0.39) MAPTABCC4ALDH1A1DDAH1GRIK1
SCHEMBL3116761 0.78 SLC1A3 (0.42) MAPTABCC4TDP1ALDH1A1DDAH1
SCHEMBL4539895 0.78 TSHR (0.38) MAPTABCC4ALDH1A1DDAH1GRIK1
SCHEMBL10967083 0.78 ABCC4 (0.34) MAPTABCC4TDP1ALDH1A1DDAH1
SCHEMBL6120459 0.78 TSHR (0.38) MAPTABCC4ALDH1A1DDAH1GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3681875-B1 CYCLIC PEPTIDE ANTIBIOTICS HOFFMANN LA ROCHE (CH) 2026-01-14 EP disclosed
US-11279735-B2 Cyclic peptide antibiotics GENENTECH, INC. (US) 2022-03-22 US disclosed
US-20200331968-A1 CYCLIC PEPTIDE ANTIBIOTICS GENENTECH, INC. (US) 2020-10-22 US disclosed
EP-3681875-A1 CYCLIC PEPTIDE ANTIBIOTICS H. Hoffnabb-La Roche Ag (CH) 2020-07-22 EP disclosed
CN-111148739-A Cyclopeptide antibiotics 豪夫迈·罗氏有限公司 2020-05-12 CN disclosed
WO-2019052545-A1 CYCLIC PEPTIDE ANTIBIOTICS F. HOFFMANN-LA ROCHE AG (CH) 2019-03-21 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 (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-20200331968-A1 CYCLIC PEPTIDE ANTIBIOTICS NPPA, LNPEP, CLPP MAPT 4597/4885ABCC4 2709/4885TDP1 2506/4885
US-11279735-B2 Cyclic peptide antibiotics NPPA, LNPEP, CLPP MAPT 4597/4885ABCC4 2709/4885TDP1 2506/4885

“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.