SCHEMBL6308176

SCHEMBL6308176

O=C1O[C@@H](CNC(=S)C(F)F)CN1c1ccc(N2CC[S+]([O-])CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.47
F2 P00734 1/20 0.44
MAOB P27338 3/20 0.43
LMNA P02545 1/20 0.43
MAOA P21397 1/20 0.43
PTGS1 P23219 1/20 0.43
CALML3 P27482 1/20 0.43
SDHA P31040 1/20 0.43
ITGB3 P05106 6/20 0.42
ITGA2B P08514 6/20 0.42
PRSS1 P07477 2/20 0.42
PRSS2 P07478 2/20 0.42
PRSS3 P35030 2/20 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
SCHEMBL6308013 0.87 F10 (0.49) F10F2
SCHEMBL6307450 0.86 MAOA (0.43) F10MAOBLMNAMAOAPTGS1
SCHEMBL6308957 0.85 MAOB (0.55) F10MAOBLMNAMAOAPTGS1
SCHEMBL6309326 0.84 F10 (0.50) F10F2MAOBLMNAMAOA
SCHEMBL6309322 0.84 F10 (0.48) F10F2MAOBLMNAMAOA
SCHEMBL5218235 0.84 F10 (0.53) F10F2MAOBLMNAMAOA
SCHEMBL6308929 0.83 MAOA (0.58) F10F2MAOBLMNAMAOA
SCHEMBL6314903 0.81 MAOA (0.46) F10MAOBLMNAMAOAPTGS1
SCHEMBL6306759 0.81 F10 (0.49) F10F2MAOBLMNAMAOA
SCHEMBL6306773 0.81 F10 (0.49) F10F2MAOBLMNAMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040077626-A1 Difluorothioacetamides of oxazolidinones as antibacterial agents PHARMACIA & UPJOHN COMPANY 2004-04-22 US claimed
US-6927229-B2 Difluorothioacetamides of oxazolidinones as antibacterial agents PHARMACIA & UPJOHN COMPANY (US) 2005-08-09 US disclosed
US-20040077626-A1 Difluorothioacetamides of oxazolidinones as antibacterial agents PHARMACIA & UPJOHN COMPANY 2004-04-22 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-20040077626-A1 Difluorothioacetamides of oxazolidinones as antibacterial agents AADAC, DLAT, OXA1L F10 4257/4885F2 4575/4885MAOB 3725/4885

“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.