SCHEMBL21609575

SCHEMBL21609575

C=Cc1nc(-c2nc3cc(C(F)(F)F)cnc3n2C)c(S(=O)(=O)CC)n1C

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
S1PR1 P21453 1/20 0.30
CRHR1 P34998 1/20 0.30
AGBL2 Q5U5Z8 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL25704139 0.86 POLB (0.41) POLB
SCHEMBL21609571 0.85 POLB (0.46) POLBS1PR1AGBL2MEN1KMT2A
SCHEMBL19712005 0.84 POLB (0.44) POLBS1PR1MEN1KMT2A
SCHEMBL18737552 0.84 POLB (0.41) POLB
SCHEMBL21550152 0.83 POLB (0.43) POLBS1PR1
SCHEMBL30080648 0.82 POLB (0.44) POLBS1PR1MEN1KMT2A
SCHEMBL21550082 0.82 POLB (0.42) POLBMEN1KMT2A
SCHEMBL19711923 0.82 POLB (0.42) POLBMEN1KMT2A
SCHEMBL19712043 0.82 POLB (0.42) POLB
SCHEMBL19711919 0.82 POLB (0.42) POLBS1PR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240190867-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2024-06-13 US disclosed
EP-3814346-B1 HETEROCYCLIC DERIVATIVES AS PESTICIDES BAYER AG (DE) 2024-03-20 EP disclosed
US-11926623-B2 Heterocycle derivatives as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2024-03-12 US disclosed
CN-112368280-B Heterocyclic derivatives as pest control agents 拜耳公司 2023-01-20 CN disclosed
US-20210139480-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2021-05-13 US disclosed
US-20210139480-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2021-05-13 US disclosed
EP-3814346-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS Bayer Aktiengesellschaft (DE) 2021-05-05 EP disclosed
CN-112368280-A Heterocyclic derivatives as pest control agents 拜耳公司 2021-02-12 CN disclosed
WO-2020002082-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2020-01-02 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 (3 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-20240190867-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, CBR3, CBR1 POLB 4612/4885S1PR1 2531/4885CRHR1 2441/4885
US-20210139480-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, CBR3, CBR1 POLB 4632/4885S1PR1 2554/4885CRHR1 2273/4885
US-11926623-B2 Heterocycle derivatives as pesticides DDT, CBR3, CBR1 POLB 4632/4885S1PR1 2554/4885CRHR1 2273/4885

“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.