SCHEMBL3120791

SCHEMBL3120791

[CH2]C(C(=O)OC)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
ACHE P22303 1/20 0.34
CA14 Q9ULX7 2/20 0.33
CA12 O43570 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPK1 P28482 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HTT P42858 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
SCHEMBL1241162 0.74 SMN1; SMN2 (0.42) SMN1; SMN2CA1CA2ACHECA14
SCHEMBL3140450 0.74 SMN1; SMN2 (0.42) SMN1; SMN2CA1CA2ACHECA14
SCHEMBL2828705 0.72 SMN1; SMN2 (0.40) SMN1; SMN2CA1CA2ACHECA14
SCHEMBL8948329 0.72 SMN1; SMN2 (0.40) SMN1; SMN2CA1CA2ACHECA14
SCHEMBL197319 0.72 SMN1; SMN2 (0.40) SMN1; SMN2CA1CA2ACHECA14
SCHEMBL23130631 0.72 SMN1; SMN2 (0.42) SMN1; SMN2CA1CA2ACHECA14
SCHEMBL10710117 0.72 SMN1; SMN2 (0.42) SMN1; SMN2CA1CA2ACHECA14
SCHEMBL7661704 0.70
SCHEMBL8777192 0.70 SMN1; SMN2 (0.39) SMN1; SMN2CA1CA2ACHECA14
SCHEMBL8777191 0.70 SMN1; SMN2 (0.39) SMN1; SMN2CA1CA2ACHECA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160050930-A1 METHODS OF CONTROLLING NEONICOTINOID RESISTANT PESTS SYNGENTA LIMITED (UK) 2016-02-25 US disclosed
EP-2978316-A1 METHODS OF CONTROLLING NEONICOTINOID RESISTANT PESTS Syngenta Participations AG (CH) 2016-02-03 EP disclosed
WO-2014154488-A1 METHODS OF CONTROLLING NEONICOTINOID RESISTANT PESTS SYNGENTA PARTICIPATIONS AG (CH) 2014-10-02 WO disclosed
WO-2010025871-A1 4-HALOGEN ALKYL-SUBSTITUTED DIAMINOPYRIMIDINES FOR USE AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-03-11 WO disclosed
EP-2161259-A1 4-Haloalkyl substituted Diaminopyrimidine Bayer CropScience AG (DE) 2010-03-10 EP 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-20160050930-A1 METHODS OF CONTROLLING NEONICOTINOID RESISTANT PESTS DDT, CRY1, NISCH SMN1; SMN2 271/4885CA1 2319/4885CA2 2629/4885

“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.