SCHEMBL20610248

SCHEMBL20610248

CCS(=O)(=O)c1cc(C(F)(F)F)cnc1-c1nc2cc(S(=O)(=O)C(F)F)ncc2n1C

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ S1PR1 P21453 1/20 0.32
▸ DDR1 Q08345 1/20 0.31
▸ AGBL2 Q5U5Z8 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
SCHEMBL17901810 0.88 LMNA (0.34) POLBS1PR1DDR1AGBL2
SCHEMBL18624700 0.86 POLB (0.35) POLBS1PR1DDR1AGBL2
SCHEMBL17018436 0.85 POLB (0.35) POLBS1PR1DDR1AGBL2
SCHEMBL20610184 0.84 POLB (0.34) POLBS1PR1DDR1AGBL2
SCHEMBL16389599 0.84 POLB (0.34) POLBS1PR1DDR1AGBL2
SCHEMBL20610194 0.84 POLB (0.34) POLBS1PR1DDR1
SCHEMBL17901874 0.84 POLB (0.36) POLBS1PR1DDR1
SCHEMBL17901876 0.83 POLB (0.35) POLBS1PR1DDR1
SCHEMBL20610238 0.83 CYP1A2 (0.32) CYP1A2GAA
SCHEMBL19755916 0.82 POLB (0.37) POLBS1PR1DDR1AGBL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3649128-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS Syngenta Participations AG (CH) 2020-05-13 — — EP disclosed
US-20200131177-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2020-04-30 — — US disclosed
US-20200131177-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2020-04-30 — — US disclosed
WO-2019008115-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-01-10 — — WO disclosed
WO-2019008115-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-01-10 — — WO 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-20200131177-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS DDT, ACHE, SQOR POLB 3997/4885CYP1A2 71/4885GAA 3463/4885

“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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