SCHEMBL20547446

SCHEMBL20547446

CCS(=O)(=O)c1c(-c2nc3cc(C(F)(F)F)ncc3n2C)sc2c(NC(C)=O)csc12

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 7/20 0.33
▸ S1PR1 P21453 2/20 0.32
▸ RORA P35398 2/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ JAK1 P23458 1/20 0.31
▸ TYK2 P29597 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ KIT P10721 1/20 0.30
▸ OGA O60502 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
SCHEMBL29581586 1.00 RORC (0.33) RORCS1PR1RORAPIK3CAJAK1
SCHEMBL21875176 0.92 RORC (0.33) RORC
SCHEMBL29581884 0.92 RORC (0.33) RORC
SCHEMBL21948582 0.90 RORC (0.34) RORC
SCHEMBL24361053 0.89 KCNH2 (0.30) RORCKCNH2
SCHEMBL20547491 0.86 KCNH2 (0.33) KCNH2
SCHEMBL21949317 0.86 KCNH2 (0.32) KCNH2
SCHEMBL29581433 0.86 KCNH2 (0.33) KCNH2
SCHEMBL21875181 0.86 RORC (0.32) RORC
SCHEMBL21949320 0.86 RORC (0.36) RORCJAK1TYK2

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
CN-110582503-B Fused bicyclic heterocyclic compound derivatives as pest control agents 拜耳公司 2022-05-31 — — CN disclosed
EP-3615540-B1 CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AG (DE) 2022-04-27 — — EP disclosed
EP-3615540-B1 CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AG (DE) 2022-04-27 — — EP disclosed
US-20200128830-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2020-04-30 — — US disclosed
US-20200128830-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2020-04-30 — — US disclosed
EP-3615540-A1 CONDENSED BICYCLIC HETEROCYCLIC-COMPOUND DERIVATIVES AS PEST CONTROL AGENTS Bayer Aktiengesellschaft (DE) 2020-03-04 — — EP disclosed
CN-110582503-A Fused bicyclic heterocyclic compound derivatives as pest control agents 拜耳公司 2019-12-17 — — CN disclosed
WO-2018197257-A1 CONDENSED BICYCLIC HETEROCYCLIC-COMPOUND DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2018-11-01 — — 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-20200128830-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, ACHE, BCHE RORC 3617/4885S1PR1 2918/4885RORA 3045/4885

“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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