SCHEMBL6208779

SCHEMBL6208779

CC(=O)NC[C@H]1CN(c2ccc(N3C[C@@H]4C(C(=O)O)[C@@H]4C3)cc2)C(=O)O1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.57
MAOB P27338 2/20 0.57
LMNA P02545 1/20 0.57
PTGS1 P23219 1/20 0.57
CALML3 P27482 1/20 0.57
SDHA P31040 1/20 0.57
F10 P00742 10/20 0.54
ITGB3 P05106 7/20 0.54
ITGA2B P08514 7/20 0.54
PRSS1 P07477 5/20 0.54
PRSS2 P07478 5/20 0.54
PRSS3 P35030 5/20 0.54
F2 P00734 2/20 0.52
ABCB11 O95342 1/20 0.50

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
SCHEMBL6337787 0.90 MAOA (0.56) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6335647 0.87 MAOA (0.58) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6478137 0.86 F10 (0.52) F10ITGB3ITGA2BPRSS1PRSS2
SCHEMBL6487750 0.86 F10 (0.49) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6478229 0.86 MAOA (0.73) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6210096 0.85 MAOA (0.54) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL13298924 0.84 MAOA (0.61) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL27951203 0.84 F10 (0.64) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6097066 0.84 F10 (0.64) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL6478558 0.84 F10 (0.48) MAOAMAOBLMNAPTGS1CALML3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1549641-A1 ANTIMICROBIAL 3.1.0 BICYCLIC OXAZOLIDINONE DERIVATIVES Pharmacia & Upjohn Company LLC (US) 2005-07-06 EP disclosed
US-6875784-B2 Antimibicrobial [3.1.0.] bicyclic oxazolidinone derivatives PHARMACIA & UPJOHN COMPANY (US) 2005-04-05 US disclosed
US-20040127530-A1 Antimibicrobial [3.1.0.] bicyclic oxazolidinone derivatives PHARMACIA & UPJOHN COMPANY 2004-07-01 US disclosed
WO-2004033451-A1 ANTIMICROBIAL [3.1.0] BICYCLIC OXAZOLIDINONE DERIVATIVES PHARMACIA & UPJOHN COMPANY LLC (US) 2004-04-22 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-20040127530-A1 Antimibicrobial [3.1.0.] bicyclic oxazolidinone derivatives OXA1L, CYP1B1, MT-CO1 MAOA 743/4885MAOB 739/4885LMNA 2200/4885

“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.