SCHEMBL29910683

SCHEMBL29910683

Cc1ccc(C(C)C)c(OC(=O)CC(C)C)c1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL19919418 1.00 LMNA (0.53) LMNAL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL18256026 0.87 LMNA (0.56) LMNAL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL30464895 0.87 LMNA (0.56) LMNAL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL249686 0.85 ALDH1A1 (0.56) LMNAL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL23318128 0.84 ALOX15 (0.48) LMNAL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL23707017 0.84 LMNA (0.53) LMNAL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL22580428 0.84 L3MBTL1 (0.56) LMNAL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL24378768 0.84 LMNA (0.53) LMNAL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL11578073 0.84 LMNA (0.53) LMNAL3MBTL1KDM4EALDH1A1TDP1
SCHEMBL30464896 0.84 LMNA (0.53) LMNAL3MBTL1KDM4EALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230174457-A1 INSECT REPELLENT COMPOUNDS AND COMPOSITIONS, AND METHODS THEREOF UNIV IOWA STATE RES FOUND INC (US) 2023-06-08 US claimed
US-20240391864-A1 INSECT REPELLENT COMPOUNDS AND COMPOSITIONS, AND METHODS THEREOF UNIV IOWA STATE RES FOUND INC (US) 2024-11-28 US disclosed
EP-4382518-A2 INSECT REPELLENT COMPOUNDS AND COMPOSITIONS, AND METHODS THEREOF Iowa State University Research Foundation, Inc. (US) 2024-06-12 EP disclosed
EP-3503733-B1 INSECT REPELLENT COMPOUNDS AND COMPOSITIONS, AND METHODS THEREOF UNIV IOWA STATE RES FOUND INC (US) 2024-03-20 EP disclosed
CN-117442652-A Application of Yun Weiling in preparation of medicine for preventing or treating constipation 云南省中医医院(云南中医药大学第一附属医院) 2024-01-26 CN disclosed
US-20230174457-A1 INSECT REPELLENT COMPOUNDS AND COMPOSITIONS, AND METHODS THEREOF UNIV IOWA STATE RES FOUND INC (US) 2023-06-08 US disclosed
US-11485701-B2 Insect repellent compounds and compositions, and methods thereof IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2022-11-01 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 (3 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-11485701-B2 Insect repellent compounds and compositions, and methods thereof C5, CYP51A1, DDT LMNA 2644/4885L3MBTL1 164/4885KDM4E 460/4885
US-20230174457-A1 INSECT REPELLENT COMPOUNDS AND COMPOSITIONS, AND METHODS THEREOF C5, CYP51A1, DDT LMNA 2644/4885L3MBTL1 164/4885KDM4E 460/4885
US-20240391864-A1 INSECT REPELLENT COMPOUNDS AND COMPOSITIONS, AND METHODS THEREOF C5, CYP51A1, DDT LMNA 2644/4885L3MBTL1 164/4885KDM4E 460/4885

“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.