SCHEMBL20386958

SCHEMBL20386958

CCS(=O)(=O)c1c(-c2nc3cc(C(F)(F)F)ncc3n2C)nc(C2CC2)n1C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 10/20 0.36
▸ RORC P51449 2/20 0.34
▸ MCHR1 Q99705 3/20 0.33
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ KCNH2 Q12809 2/20 0.31
▸ NR1H2 P55055 1/20 0.30
▸ NR1H3 Q13133 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 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
SCHEMBL20386813 0.96 CNR2 (0.34) CNR2RORCMCHR1CYP11B1CYP11B2
SCHEMBL20386808 0.95 CNR2 (0.35) CNR2RORCMCHR1KCNH2
SCHEMBL20386811 0.95 CNR2 (0.40) CNR2RORCMCHR1CYP11B1CYP11B2
SCHEMBL20386807 0.93 CNR2 (0.32) CNR2RORCMCHR1CYP11B1CYP11B2
SCHEMBL20386962 0.92 CNR2 (0.38) CNR2RORCCYP11B1CYP11B2KCNH2
SCHEMBL20386960 0.91 CNR2 (0.33) CNR2RORCMCHR1CYP11B1CYP11B2
SCHEMBL20393874 0.85 LMNA (0.35) CNR2RORCKCNH2NR1H2NR1H3
SCHEMBL19876674 0.84 NR1H2 (0.32) CNR2RORCMCHR1CYP11B1CYP11B2
SCHEMBL19888424 0.84 NR1H2 (0.32) CNR2RORCCYP11B1CYP11B2NR1H2
SCHEMBL29683582 0.84 NR1H2 (0.32) CNR2RORCMCHR1CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11058115-B2 Heterocycle derivatives as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2021-07-13 — — US disclosed
EP-3568392-B1 IMIDAZOLE DERIVATIVES AS PEST CONTROL AGENTS BAYER AG (DE) 2021-02-24 — — EP disclosed
US-20200054017-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-02-20 — — US disclosed
WO-2018130437-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-11058115-B2 Heterocycle derivatives as pesticides DDT, CBR3, CBR1 CNR2 624/4885RORC 3071/4885MCHR1 585/4885
US-20200054017-A1 HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, CBR3, CBR1 CNR2 624/4885RORC 3071/4885MCHR1 585/4885

“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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