Acanthoic Acid

Acanthoic Acid

SCHEMBL280424

C=C[C@@]1(C)CC=C2[C@@H](CCC3[C@](C)(C(=O)O)CCC[C@@]23C)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NR1H3 Q13133 2/20 1.00
▸ PTPN1 P18031 1/20 1.00
▸ PTGS1 P23219 11/20 0.79
▸ RXRA P19793 1/20 0.48
▸ RXRB P28702 1/20 0.48
▸ RXRG P48443 1/20 0.48

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
Acanthoic Acid SCHEMBL1545993 1.00 NR1H3 (1.00) NR1H3PTPN1PTGS1RXRARXRB
Acanthoic Acid SCHEMBL280467 1.00 NR1H3 (1.00) NR1H3PTPN1PTGS1RXRARXRB
Acanthoic Acid SCHEMBL12450156 1.00 NR1H3 (1.00) NR1H3PTPN1PTGS1RXRARXRB
Acanthoic Acid SCHEMBL12450150 1.00 NR1H3 (1.00) NR1H3PTPN1PTGS1RXRARXRB
Acanthoic Acid SCHEMBL266801 1.00 NR1H3 (1.00) NR1H3PTPN1PTGS1RXRARXRB
SCHEMBL267218 0.91 NR1H3 (0.83) NR1H3PTPN1PTGS1RXRARXRB
SCHEMBL260906 0.91 NR1H3 (0.83) NR1H3PTPN1PTGS1RXRARXRB
SCHEMBL2730943 0.91 NR1H3 (0.83) NR1H3PTPN1PTGS1RXRARXRB
SCHEMBL12450181 0.91 NR1H3 (0.83) NR1H3PTPN1PTGS1RXRARXRB
SCHEMBL261332 0.89 NR1H3 (0.81) NR1H3PTPN1PTGS1RXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133915-B2 Interleukin-1 and tumor necrosis factor-α modulators; syntheses of such modulators and methods of using such modulators NEREUS PHARMACEUTICALS, INC. (US) 2012-03-13 — — US disclosed
US-20110160309-A1 INTERLEUKIN-1 AND TUMOR NECROSIS FACTOR-ALPHA MODULATORS; SYNTHESES OF SUCH MODULATORS AND METHODS OF USING SUCH MODULATORS NEREUS PHARMACEUTICALS, INC. (US) 2011-06-30 — — US disclosed
US-7893299-B2 Acanthoic amide derivatives; inflammation, cancer, cachexia, cardiovascular disease, infections, diabetes, otitis media, sinusitis, transplant rejection NEREUS PHARMACEUTICALS, INC. (US) 2011-02-22 — — 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 (1 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-20110160309-A1 INTERLEUKIN-1 AND TUMOR NECROSIS FACTOR-ALPHA MODULATORS; SYNTHESES OF SUCH MODULATORS AND METHODS OF USING SUCH MODULATORS IL1A, IL1B, TNF NR1H3 3538/4885PTPN1 2008/4885PTGS1 20/4885

“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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