SCHEMBL30122103

SCHEMBL30122103

CC[S@](=N)(=O)c1cc(C2(C#N)CC2)ccc1-c1nc2cc(C(F)(F)F)cnc2n1C

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.38
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ TNF P01375 1/20 0.32
▸ BDKRB1 P46663 1/20 0.31
▸ KCNH2 Q12809 1/20 0.30
▸ PRKCE Q02156 1/20 0.30
▸ PDE2A O00408 1/20 0.30

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
SCHEMBL21586224 1.00 POLB (0.38) POLBTRPM8CYP1A2ALDH1A1TNF
SCHEMBL30122116 1.00 POLB (0.38) POLBTRPM8CYP1A2ALDH1A1TNF
SCHEMBL21589994 0.92 POLB (0.38) POLB
SCHEMBL21586201 0.87 POLB (0.38) POLBTRPM8TNF
SCHEMBL30122145 0.87 POLB (0.38) POLBTRPM8TNF
SCHEMBL24696189 0.87 POLB (0.38) POLBTRPM8TNF
SCHEMBL30401655 0.87 POLB (0.38) POLBTRPM8TNF
SCHEMBL25519188 0.87 POLB (0.41) POLB
SCHEMBL25517905 0.86 POLB (0.39) POLB
SCHEMBL25517849 0.86 AGPAT2 (0.38) TRPM8CYP1A2ALDH1A1PDE2A

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
EP-4347591-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFOXIMINE CONTAINING SUBSTITUENTS Syngenta Crop Protection AG (CH) 2024-04-10 — — EP claimed
WO-2022253841-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFOXIMINE CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2022-12-08 — — WO claimed
US-20250081967-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFOXIMINE CONTAINING SUBSTITUENTS SYNGENTA CROP PROTECTION AG (CH) 2025-03-13 — — 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 (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-20250081967-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFOXIMINE CONTAINING SUBSTITUENTS DDT, AADAC, SMOX POLB 4001/4885TRPM8 4461/4885CYP1A2 348/4885

“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.

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