SCHEMBL30212097

SCHEMBL30212097

CCC(=O)c1c(O)cc(OC)c(CC2=C(O)C(C)(C)C(=O)C(C(C)=O)=C2O)c1O

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FASN P49327 9/20 0.59
▸ HMGCR P04035 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ PAK1 Q13153 1/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ CA9 Q16790 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL30212080 0.92 FASN (0.66) FASNHMGCRMEN1KMT2APAK1
SCHEMBL30212085 0.88 FASN (0.66) FASNHMGCRMEN1KMT2APAK1
SCHEMBL29387296 0.86 FASN (0.59) FASNHMGCRMEN1KMT2APAK1
SCHEMBL30212066 0.80 FASN (0.72) FASN
SCHEMBL30212065 0.80 FASN (0.72) FASN
Desaspidin SCHEMBL29613713 0.76 FASN (0.51) FASNHMGCRMEN1KMT2APAK1
Desaspidin SCHEMBL2732746 0.76 FASN (0.51) FASNHMGCRMEN1KMT2APAK1
SCHEMBL30212088 0.76 FASN (0.72) FASN
SCHEMBL30212090 0.75 FASN (1.00) FASNMEN1KMT2A
SCHEMBL30212107 0.74 FASN (0.77) FASN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12178790-B2 Antibacterial compound isolated from Psiloxylon mauritianum and its derivatives SORRES, Jonathan (FR) 2024-12-31 — — US disclosed
US-20230062900-A1 NEW ANTIBACTERIAL COMPOUND ISOLATED FROM PSILOXYLON MAURITIANUM AND ITS DERIVATIVES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2023-03-02 — — 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-20230062900-A1 NEW ANTIBACTERIAL COMPOUND ISOLATED FROM PSILOXYLON MAURITIANUM AND ITS DERIVATIVES PNN, AAAS, MRPS35 FASN 37/4885HMGCR 2105/4885MEN1 2121/4885
US-12178790-B2 Antibacterial compound isolated from Psiloxylon mauritianum and its derivatives AAAS, PNN, MRPL9 FASN 27/4885HMGCR 2026/4885MEN1 1932/4885

“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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