SCHEMBL20819264

SCHEMBL20819264

CCS(=O)(=O)c1cc(C(C)(C)C#N)cnc1-n1cc2cnc(C(F)(F)F)cc2n1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.33
EGLN1 Q9GZT9 1/20 0.32
DDR1 Q08345 3/20 0.32
LRRK2 Q5S007 1/20 0.32

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
SCHEMBL29787140 1.00 S1PR1 (0.33) S1PR1EGLN1DDR1LRRK2
SCHEMBL17504810 0.90 DDR1 (0.36) EGLN1DDR1
SCHEMBL29787145 0.85 USP1 (0.33) S1PR1EGLN1
SCHEMBL20819268 0.85 USP1 (0.33) S1PR1EGLN1
SCHEMBL25669933 0.84 S1PR1 (0.31) S1PR1
SCHEMBL21761834 0.83 EGLN1 (0.32) EGLN1DDR1
SCHEMBL17504809 0.83 DDR1 (0.34) EGLN1DDR1
SCHEMBL29787144 0.83 DDR1 (0.34) EGLN1DDR1
SCHEMBL20829885 0.83 LRRK2 (0.32) EGLN1LRRK2
SCHEMBL21750107 0.80 EGLN1 (0.42) EGLN1DDR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3684768-B1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2024-01-24 EP disclosed
EP-3684768-B1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2024-01-24 EP disclosed
US-11413291-B2 Pesticidally active heterocyclic derivatives with sulfur containing substituents SYNGENTA PARTICIPATIONS AG (CH) 2022-08-16 US disclosed
US-20200268760-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2020-08-27 US disclosed
US-20200268760-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2020-08-27 US disclosed
EP-3684768-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS Syngenta Participations AG (CH) 2020-07-29 EP disclosed
WO-2019053182-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-03-21 WO disclosed
WO-2019053182-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2019-03-21 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 (2 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-11413291-B2 Pesticidally active heterocyclic derivatives with sulfur containing substituents DDT, ACHE, SQOR S1PR1 2950/4885EGLN1 3167/4885DDR1 4459/4885
US-20200268760-A1 PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS DDT, ACHE, SQOR S1PR1 2950/4885EGLN1 3167/4885DDR1 4459/4885

“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.