Agathic Acid

Agathic Acid

SCHEMBL30436331

C=C1CCC2C(C)(C(=O)O)CCCC2(C)C1CC/C(C)=C\C(=O)O

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAS2R31 P59538 1/20 0.64
POLB P06746 1/20 0.62
MAPT P10636 1/20 0.62
PTPN1 P18031 7/20 0.61
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MMP2 P08253 1/20 0.44
PTPN2 P17706 1/20 0.44
PNLIP P16233 1/20 0.44

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
Agathic Acid SCHEMBL21914839 1.00 TAS2R31 (0.64) TAS2R31POLBMAPTPTPN1CYP2C9
Agathic Acid SCHEMBL29358171 1.00 TAS2R31 (0.64) TAS2R31POLBMAPTPTPN1CYP2C9
SCHEMBL30436964 0.90 POLB (0.58) TAS2R31POLBMAPTPTPN1CYP2C9
Isocupressic Acid SCHEMBL13532265 0.89 POLB (0.66) TAS2R31POLBMAPTPTPN1CYP2C9
Isocupressic Acid SCHEMBL19139984 0.89 POLB (0.66) TAS2R31POLBMAPTPTPN1CYP2C9
Copalic Acid SCHEMBL25221800 0.89 TAS2R31 (0.66) TAS2R31POLBMAPTPTPN1LMNA
Copalic Acid SCHEMBL29481956 0.89 TAS2R31 (0.66) TAS2R31POLBMAPTPTPN1LMNA
Copalic Acid SCHEMBL34460866 0.89 TAS2R31 (0.66) TAS2R31POLBMAPTPTPN1LMNA
SCHEMBL15214261 0.88 POLB (0.64) TAS2R31POLBMAPTPTPN1CYP2C9
SCHEMBL21914841 0.88 TAS2R31 (0.63) TAS2R31POLBMAPTPTPN1LMNA

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-20240389587-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PHYTOPATHOGENIC INFECTIONS INSTITUT NATIONAL DE RECHERCHE POUR L'AGRICULTURE, L'ALIMENTATION ET L'ENVIRONNEMENT (INRAE) (FR) 2024-11-28 US disclosed
EP-4186367-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PHYTOPATHOGENIC INFECTIONS Institut national de recherche pour l'agriculture, l'alimentation et l'environnement (INRAE) (FR) 2023-05-31 EP 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-20240389587-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PHYTOPATHOGENIC INFECTIONS XBP1, ERN1, ERN2 TAS2R31 3780/4885POLB 4124/4885MAPT 1442/4885

“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.