SCHEMBL2367201

SCHEMBL2367201

CC(C)(C)OC(=O)Nc1cccc(C[C@H](N)C(=O)OC(=O)OCc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.47
▸ MGLL Q99685 3/20 0.46
▸ SLC7A5 Q01650 1/20 0.46
▸ TOP2A P11388 1/20 0.46
▸ TOP2B Q02880 1/20 0.46
▸ NOS3 P29474 1/20 0.45
▸ NOS1 P29475 1/20 0.45
▸ NOS2 P35228 1/20 0.45
▸ LTA4H P09960 2/20 0.43
▸ SYK P43405 1/20 0.43
▸ ENPP2 Q13822 1/20 0.43
▸ AURKA O14965 1/20 0.42
▸ RPS6KB1 P23443 1/20 0.42
▸ BACE1 P56817 2/20 0.42
▸ NPY1R P25929 1/20 0.42

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
SCHEMBL4099182 0.85 MGLL (0.49) RAB9AMGLLTOP2ATOP2BSYK
SCHEMBL2367419 0.85 SLC7A5 (0.50) SLC7A5NOS3NOS1NOS2LTA4H
SCHEMBL2367046 0.84 KMT2A (0.44) SLC7A5LTA4HSYK
SCHEMBL2367408 0.84 KMT2A (0.44) SLC7A5LTA4HSYK
SCHEMBL3050840 0.84 SLC7A5 (0.64) SLC7A5NOS3NOS1NOS2AURKA
SCHEMBL2367233 0.84 SLC7A5 (0.64) SLC7A5NOS3NOS1NOS2AURKA
SCHEMBL9175958 0.80 TOP2A (0.46) RAB9ASLC7A5TOP2ATOP2BNOS3
SCHEMBL2367757 0.79 SYK (0.60) LTA4HSYK
SCHEMBL2367199 0.79 ITGB3 (0.60) MGLLSYKENPP2BACE1
SCHEMBL2366818 0.79 ITGB3 (0.60) MGLLSYKENPP2BACE1

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
EP-2007794-B1 LYSOBACTIN AMIDES AICURIS GMBH & CO KG (DE) 2011-09-14 — — EP disclosed
US-20090203582-A1 LYSOBACTIN AMIDES BAYER HEALTHCARE AG (DE) 2009-08-13 — — 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-20090203582-A1 LYSOBACTIN AMIDES AADAT, HAMP, DLST RAB9A 2772/4885MGLL 1373/4885SLC7A5 298/4885

“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.

Send feedback