SCHEMBL16554686

SCHEMBL16554686

N#Cc1cncc(C2(C(N)=S)C[C@H]3CC[C@@H](C2)N3CC(F)(F)F)c1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.34
CYP11B2 P19099 2/20 0.33
CYP11B1 P15538 1/20 0.33
USP14 P54578 1/20 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
SCHEMBL16565820 1.00 BACE1 (0.34) BACE1CYP11B2CYP11B1USP14
SCHEMBL16565850 0.86 TRPA1 (0.34)
SCHEMBL16554594 0.86 TRPA1 (0.34)
SCHEMBL16565819 0.84
SCHEMBL16554473 0.84
SCHEMBL16565821 0.83 CYP11B2 (0.31) CYP11B2
SCHEMBL7694965 0.81 CYP11B1 (0.35) BACE1CYP11B2CYP11B1USP14
SCHEMBL16565894 0.78
SCHEMBL17940883 0.78
SCHEMBL17940936 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160214974-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-07-28 US disclosed
EP-3041833-A1 INSECTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2016-07-13 EP disclosed
WO-2015032617-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2015-03-12 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-20160214974-A1 INSECTICIDAL COMPOUNDS ACHE, CYP1B1, CHRM1 BACE1 1284/4885CYP11B2 2471/4885CYP11B1 1582/4885

“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.