SCHEMBL29649857

SCHEMBL29649857

C[C@@H]1CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](OC(=O)/C=C\c6ccc(O)cc6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2[C@]1(C)O

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.73
PDE5A O76074 1/20 0.73
PDE9A O76083 1/20 0.73
PDE1B Q01064 1/20 0.73
GYS2 P54840 1/20 0.69
SENP1 Q9P0U3 2/20 0.67
ACHE P22303 1/20 0.61
HSD11B1 P28845 1/20 0.60
PTPN1 P18031 5/20 0.59
RELA Q04206 1/20 0.58
POLB P06746 1/20 0.57
PTPN2 P17706 1/20 0.53
ACP1 P24666 1/20 0.53
EGFR P00533 1/20 0.52

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
SCHEMBL24433072 1.00 PDE4D (0.73) PDE4DPDE5APDE9APDE1BGYS2
SCHEMBL12181490 1.00 PDE4D (0.73) PDE4DPDE5APDE9APDE1BGYS2
SCHEMBL29649785 1.00 PDE4D (0.73) PDE4DPDE5APDE9APDE1BGYS2
SCHEMBL24433073 1.00 PDE4D (0.73) PDE4DPDE5APDE9APDE1BGYS2
SCHEMBL12181496 1.00 PDE4D (0.73) PDE4DPDE5APDE9APDE1BGYS2
SCHEMBL15163880 0.95 PDE4D (0.68) PDE4DPDE5APDE9APDE1BGYS2
SCHEMBL15163884 0.95 PDE4D (0.68) PDE4DPDE5APDE9APDE1BGYS2
SCHEMBL30925714 0.90 GYS2 (0.85) PDE4DPDE5APDE9APDE1BGYS2
SCHEMBL13487369 0.89 PDE4D (0.80) PDE4DPDE5APDE9APDE1BHSD11B1
SCHEMBL13487370 0.89 PDE4D (0.80) PDE4DPDE5APDE9APDE1BHSD11B1

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-20220151970-A1 METHOD FOR PRODUCING A COMPOSITION COMPRISING A 3-O-p-COUMAROYL ESTER OF TORMENTIC ACID FROM A PLANT CELL CULTURE, APPLICATIONS THEREOF AS ANTIPARASITIC AGENT FOR THE TREATMENT OF TRYPANOSOMIASIS LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LU) 2022-05-19 US claimed
US-12605351-B2 Method for producing a composition comprising a 3-O-p-coumaroyl ester of tormentic acid from a plant cell culture, applications thereof as antiparasitic agent for the treatment of trypanosomiasis LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LU) 2026-04-21 US disclosed
WO-2023219526-A1 MULTITARGET ANTIVIRAL DIETARY SUPPLEMENT PROKIN MILAN (RS) 2023-11-16 WO disclosed
US-20220151970-A1 METHOD FOR PRODUCING A COMPOSITION COMPRISING A 3-O-p-COUMAROYL ESTER OF TORMENTIC ACID FROM A PLANT CELL CULTURE, APPLICATIONS THEREOF AS ANTIPARASITIC AGENT FOR THE TREATMENT OF TRYPANOSOMIASIS LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LU) 2022-05-19 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-20220151970-A1 METHOD FOR PRODUCING A COMPOSITION COMPRISING A 3-O-p-COUMAROYL ESTER OF TORMENTIC ACID FROM A PLANT CELL CULTURE, APPLICATIONS THEREOF AS ANTIPARASITIC AGENT FOR THE TREATMENT OF TRYPANOSOMIASIS ME3, ME1, CYP51A1 PDE4D 3648/4885PDE5A 3859/4885PDE9A 3617/4885
US-12605351-B2 Method for producing a composition comprising a 3-O-p-coumaroyl ester of tormentic acid from a plant cell culture, applications thereof as antiparasitic agent for the treatment of trypanosomiasis NFATC1, CYP51A1, ME1 PDE4D 3852/4885PDE5A 3648/4885PDE9A 2729/4885

“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.