SCHEMBL30212085

SCHEMBL30212085

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

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FASN P49327 9/20 0.66
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PAK1 Q13153 1/20 0.40
▸ HMGCR P04035 2/20 0.35
▸ PTGES O14684 1/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ CYP19A1 P11511 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
SCHEMBL29387296 0.96 FASN (0.59) FASNMEN1KMT2APAK1HMGCR
SCHEMBL30212080 0.92 FASN (0.66) FASNMEN1KMT2APAK1HMGCR
SCHEMBL30212088 0.89 FASN (0.72) FASNPTGESALOX5
SCHEMBL30212097 0.88 FASN (0.59) FASNMEN1KMT2APAK1HMGCR
Desaspidin SCHEMBL2732746 0.85 FASN (0.51) FASNMEN1KMT2APAK1HMGCR
Desaspidin SCHEMBL29613713 0.85 FASN (0.51) FASNMEN1KMT2APAK1HMGCR
SCHEMBL30212063 0.81 FASN (0.70) FASN
SCHEMBL30212066 0.81 FASN (0.72) FASNPTGESALOX5
SCHEMBL30212065 0.81 FASN (0.72) FASNPTGESALOX5
SCHEMBL30212093 0.79 FASN (0.80) FASNPTGESALOX5

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 4 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
CN-115804764-B Application of secoisolariciresinol diglucoside compound in preparation of medicine with respiratory syncytial virus resisting effect 暨南大学附属第一医院(广州华侨医院) 2024-01-26 — — CN disclosed
CN-115804764-A Application of aspidin type phloroglucinol compound in preparation of medicine with respiratory syncytial virus resisting effect 暨南大学附属第一医院(广州华侨医院) 2023-03-17 — — CN 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 37/4885MEN1 2121/4885KMT2A 4246/4885
US-12178790-B2 Antibacterial compound isolated from Psiloxylon mauritianum and its derivatives AAAS, PNN, MRPL9 FASN 27/4885MEN1 1932/4885KMT2A 4078/4885

“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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