SCHEMBL20393763

SCHEMBL20393763

CCS(=O)(=O)c1c(-c2nc3cc(C(F)(F)F)ncc3n2C)nc(-c2cc(Cl)cs2)n1C

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.34
▸ SDHB P21912 1/20 0.31
▸ DDR1 Q08345 1/20 0.30
▸ S1PR1 P21453 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
SCHEMBL20393626 0.85 PTGS2 (0.35) PTGS2SDHBDDR1S1PR1
SCHEMBL20393870 0.85 KCNH2 (0.34) SDHB
SCHEMBL20393635 0.84 SDHB (0.46) PTGS2SDHBS1PR1
SCHEMBL20393622 0.84 PTGS2 (0.44) PTGS2SDHBS1PR1
SCHEMBL20393710 0.84 PTGS2 (0.42) PTGS2
SCHEMBL21715798 0.83 LMNA (0.37) PTGS2S1PR1
SCHEMBL20393624 0.83 KCNH2 (0.31) S1PR1
SCHEMBL20393844 0.82 NPC1 (0.36) PTGS2DDR1S1PR1
SCHEMBL20393874 0.82 LMNA (0.35) S1PR1
SCHEMBL20393759 0.82 CA12 (0.34) PTGS2

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-11083199-B2 Heterocycle derivatives as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2021-08-10 — — US disclosed
US-20200045976-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-02-13 — — US disclosed
WO-2018130443-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2018-07-19 — — 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-11083199-B2 Heterocycle derivatives as pesticides DDT, CBR3, CBR1 PTGS2 3487/4885SDHB 543/4885DDR1 3853/4885
US-20200045976-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, CBR3, CBR1 PTGS2 3487/4885SDHB 543/4885DDR1 3853/4885

“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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