SCHEMBL29901231

SCHEMBL29901231

CC(C)(C(=O)Nc1cn(-c2cccnc2)nc1Cl)S(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 5/20 0.39
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.36
MAPK13 O15264 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
MAPK14 Q16539 1/20 0.36
NR3C1 P04150 1/20 0.35
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
PDK3 Q15120 1/20 0.35
PDK4 Q16654 1/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MITF O75030 1/20 0.35
HPGD P15428 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
SCHEMBL22895196 1.00 IRAK4 (0.39) IRAK4TSHRMAPK1MAPK13MAPK12
SCHEMBL22895199 0.83 IRAK4 (0.40) IRAK4TSHRMAPK1MAPK13MAPK12
SCHEMBL29901178 0.83 IRAK4 (0.40) IRAK4TSHRMAPK1MAPK13MAPK12
SCHEMBL16269895 0.82 IRAK4 (0.39) IRAK4TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL22895190 0.81 GAA (0.41) IRAK4TSHRMAPK1ALDH1A1KDM4E
SCHEMBL29901199 0.81 GAA (0.41) IRAK4TSHRMAPK1ALDH1A1KDM4E
SCHEMBL16652277 0.81 SMN1; SMN2 (0.50) IRAK4TSHRMAPK1ALDH1A1KDM4E
SCHEMBL22834183 0.80 IRAK4 (0.39) IRAK4TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL4964600 0.80 HTT (0.47) IRAK4MAPK1CYP3A4SMN1; SMN2KMT2A
SCHEMBL29873929 0.80 HTT (0.47) IRAK4MAPK1CYP3A4SMN1; SMN2KMT2A

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-20250368612-A1 MOLECULE HAVING PESTICIDAL UTILITY, AND COMPOSITIONS, AND PROCESSES, RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2025-12-04 US disclosed
EP-4068971-A1 COMPOSITIONS HAVING PESTICIDAL UTILITY AND PROCESSES RELATED THERETO Corteva Agriscience LLC (US) 2022-10-12 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-20250368612-A1 MOLECULE HAVING PESTICIDAL UTILITY, AND COMPOSITIONS, AND PROCESSES, RELATED THERETO ACHE, PLA2G2D, MYO1G IRAK4 3313/4885TSHR 3415/4885MAPK1 3791/4885

“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.