SCHEMBL21467516

SCHEMBL21467516

CCS(=O)(=O)c1c(-c2nc3cc(OC(F)(F)F)ncc3n2C)nc2n1CCCC2

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TP53 P04637 5/20 0.32

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
SCHEMBL19876675 0.86 MEN1 (0.38) MEN1KMT2ATP53
SCHEMBL29683610 0.86 MEN1 (0.38) MEN1KMT2ATP53
SCHEMBL19888454 0.85 MEN1 (0.34) MEN1KMT2ATP53
SCHEMBL19888485 0.85 MEN1 (0.34) MEN1KMT2ATP53
SCHEMBL19174367 0.84 MEN1 (0.34) MEN1KMT2A
SCHEMBL19888486 0.82 ACHE (0.31) MEN1KMT2A
SCHEMBL19888456 0.80 MEN1 (0.55) MEN1KMT2ATP53
SCHEMBL19888476 0.80 MEN1 (0.36) MEN1KMT2ATP53
SCHEMBL23950026 0.78 ACHE (0.33) MEN1KMT2A
SCHEMBL19888455 0.78 POLB (0.41) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10660334-B2 Fused bicyclic heterocycle derivatives as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-05-26 — — US disclosed
US-20190313643-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-10-17 — — US 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-10660334-B2 Fused bicyclic heterocycle derivatives as pesticides DDT, BCHE, ACHE MEN1 1465/4885KMT2A 2012/4885TP53 1017/4885
US-20190313643-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, BCHE, ACHE MEN1 1465/4885KMT2A 2012/4885TP53 1017/4885

“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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