SCHEMBL19993254

SCHEMBL19993254

CCS(=O)(=O)c1c(-c2nc3cc(C(F)(F)F)cnc3n2C)nn2c(C)cc(C)nc12

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.42
▸ HTR6 P50406 12/20 0.36
▸ CRHR1 P34998 3/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ HTR2B P41595 1/20 0.33

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
SCHEMBL28699081 0.85 POLB (0.42) POLBHTR6CRHR1KDM4EPTGS2
SCHEMBL31121689 0.82 HTR6 (0.37) HTR6PTGS2HTR2B
SCHEMBL19973846 0.82 HTR6 (0.37) HTR6PTGS2HTR2B
SCHEMBL23956663 0.81 POLB (0.40) POLBCRHR1KDM4EPTGS2
SCHEMBL19993256 0.80 POLB (0.41) POLBHTR6KDM4EPTGS2
SCHEMBL14684583 0.78 POLB (0.48) POLBCRHR1
SCHEMBL29360277 0.78 POLB (0.48) POLBCRHR1
SCHEMBL24868761 0.78 POLB (0.41) POLBKDM4E
SCHEMBL24868773 0.78 POLB (0.41) POLBKDM4E
SCHEMBL21265226 0.77 POLB (0.41) POLBKDM4E

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
EP-3515921-B1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2021-10-27 — — EP disclosed
US-10611779-B2 Fused bicyclic heterocycle derivatives as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-04-07 — — US disclosed
US-20190248811-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-08-15 — — US disclosed
WO-2018050825-A1 PYRAZOLO [1,5-A]PYRIDINE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-03-22 — — 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-10611779-B2 Fused bicyclic heterocycle derivatives as pesticides DDT, BCHE, ACHE POLB 3706/4885HTR6 4745/4885CRHR1 2349/4885
US-20190248811-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, BCHE, ACHE POLB 3706/4885HTR6 4745/4885CRHR1 2349/4885

“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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