SCHEMBL19628408

SCHEMBL19628408

CC[C@H]1OCC[C@H](NC(=O)OC(C)(C)C)C(=O)O[C@@H](C)[C@@H]1Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.36
MAOB P27338 1/20 0.36
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.34
NAAA Q02083 2/20 0.33
KCNA3 P22001 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
SCHEMBL19628421 0.91 GAA (0.33) KDM1AGAA
SCHEMBL19628397 0.91 KMT2A (0.38) KDM1AMAOBKMT2AL3MBTL1NAAA
SCHEMBL19628402 0.89 REN (0.37) KDM1AMAOBKMT2AL3MBTL1
SCHEMBL19628394 0.87 SCN9A (0.37) KDM1AMAOBKMT2AL3MBTL1NAAA
SCHEMBL19628419 0.87 TP53 (0.34) KDM1AMAOBKMT2AL3MBTL1NAAA
SCHEMBL16604078 0.84 KMT2A (0.40) KDM1AMAOBKMT2AL3MBTL1GAA
SCHEMBL16605392 0.82 KMT2A (0.41) KDM1AMAOBKMT2AL3MBTL1GAA
SCHEMBL17898871 0.82 GAA (0.39) KDM1AMAOBKMT2AL3MBTL1GAA
SCHEMBL17898879 0.82 GAA (0.39) KDM1AMAOBKMT2AL3MBTL1GAA
SCHEMBL17898811 0.82 GAA (0.38) KDM1AMAOBKMT2AL3MBTL1GAA

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-20170334934-A1 Macrocyclic picolinamides as fungicides DOW AGROSCIENCES LLC (US) 2017-11-23 US disclosed
US-20170334934-A1 Macrocyclic picolinamides as fungicides DOW AGROSCIENCES LLC (US) 2017-11-23 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 (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-20170334934-A1 Macrocyclic picolinamides as fungicides CYP4F12, CYP1A2, FKBP2 KDM1A 1840/4885MAOB 2013/4885KMT2A 3234/4885

“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.