SCHEMBL1820443

SCHEMBL1820443

CC(C)(C)N(C(=O)O)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.57
NR1H3 Q13133 9/20 0.54
NR1H2 P55055 8/20 0.54
MLYCD O95822 7/20 0.54
LMNA P02545 2/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL19281534 0.87 NR1H3 (0.51) NR1H3NR1H2
SCHEMBL1814770 0.87 NR1H3 (0.51) NR1H3NR1H2
SCHEMBL2497436 0.84 EPHX2 (0.44) LMNAHTT
SCHEMBL19150639 0.83 RORC (0.54)
SCHEMBL2257964 0.83 NR1H2 (0.55) SMN1; SMN2NR1H3NR1H2MLYCD
SCHEMBL1812150 0.81 NR1H2 (0.44) SMN1; SMN2NR1H3NR1H2MLYCD
SCHEMBL1810316 0.77 HSD11B1 (0.40) SMN1; SMN2NR1H3NR1H2MLYCD
SCHEMBL5480662 0.77 RECQL (0.41) SMN1; SMN2LMNAHTT
SCHEMBL1816434 0.77 PGR (0.40) SMN1; SMN2NR1H3NR1H2MLYCDLMNA
SCHEMBL1530165 0.74 ESR1 (0.39) LMNAHTT

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-20110201603-A1 Novel Acylaminobenzamide Derivatives BAYER CROPSCIENCE AG (DE) 2011-08-18 US disclosed
EP-2318358-A2 ACYLAMINOBENZAMIDE DERIVATIVES Bayer CropScience AG (DE) 2011-05-11 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-20110201603-A1 Novel Acylaminobenzamide Derivatives KCNB1, KCNA5, KCNA7 SMN1; SMN2 4532/4885NR1H3 2856/4885NR1H2 3059/4885

“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.