SCHEMBL30739742

SCHEMBL30739742

CCOC(/C=C/c1ccc(Cl)c(Cl)c1)OCC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHAT P28329 1/20 0.42
NOS2 P35228 3/20 0.40
NOS3 P29474 2/20 0.40
NOS1 P29475 2/20 0.40
ALDH1A1 P00352 1/20 0.40
PYGL P06737 9/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
DHODH Q02127 1/20 0.36
GRIK1 P39086 1/20 0.36
GRIK2 Q13002 1/20 0.36
KDM4A O75164 1/20 0.36
KDM4B O94953 1/20 0.36
PTGS2 P35354 1/20 0.35
FFAR1 O14842 1/20 0.35

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
SCHEMBL18144186 1.00 CHAT (0.42) CHATNOS2NOS3NOS1ALDH1A1
SCHEMBL18144190 1.00 CHAT (0.42) CHATNOS2NOS3NOS1ALDH1A1
SCHEMBL18144158 0.86 TRPA1 (0.42) CHATALDH1A1SLC6A2SLC6A4
SCHEMBL30739641 0.86 TRPA1 (0.42) CHATALDH1A1SLC6A2SLC6A4
SCHEMBL18144160 0.86 TRPA1 (0.42) CHATALDH1A1SLC6A2SLC6A4
SCHEMBL18143986 0.83 ALDH1A1 (0.30) ALDH1A1
SCHEMBL18143983 0.83 ALDH1A1 (0.30) ALDH1A1
SCHEMBL18147749 0.79 ALDH1A1 (0.41) ALDH1A1
SCHEMBL18147746 0.79 ALDH1A1 (0.41) ALDH1A1
SCHEMBL18163169 0.78

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-20250008960-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2025-01-09 US disclosed
CN-118044519-A Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2024-05-17 CN disclosed
CN-110072842-B Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2024-02-02 CN 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-20250008960-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO ACHE, DDT, MLYCD CHAT 530/4885NOS2 257/4885NOS3 171/4885

“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.