SCHEMBL6040375

SCHEMBL6040375

CCC(=S)NC[C@H]1CN(c2ccc(N3CCN(C(=O)COC(=O)NC)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.59
MAOB P27338 7/20 0.56
MAOA P21397 4/20 0.55
LMNA P02545 1/20 0.55
PTGS1 P23219 1/20 0.55
CALML3 P27482 1/20 0.55
SDHA P31040 1/20 0.55

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
SCHEMBL7710117 0.92 F10 (0.60) F10MAOBMAOALMNAPTGS1
SCHEMBL7710113 0.92 F10 (0.60) F10MAOBMAOALMNAPTGS1
SCHEMBL7707330 0.91 F10 (0.62) F10MAOBMAOALMNAPTGS1
SCHEMBL7707326 0.91 F10 (0.62) F10MAOBMAOALMNAPTGS1
SCHEMBL6158660 0.90 F10 (0.71) F10MAOBMAOALMNAPTGS1
SCHEMBL6158654 0.90 F10 (0.71) F10MAOBMAOALMNAPTGS1
SCHEMBL6040349 0.88 F10 (0.58) F10MAOBMAOALMNAPTGS1
SCHEMBL6040546 0.88 F10 (0.63) F10MAOBMAOALMNAPTGS1
SCHEMBL7710162 0.87 MAOB (0.61) F10MAOBMAOALMNAPTGS1
SCHEMBL6040691 0.87 MAOB (0.63) F10MAOBMAOALMNAPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1263742-B1 OXAZOLIDINONE THIOAMIDES WITH PIPERAZINE AMIDE SUBSTITUENTS PHARMACIA & UPJOHN CO LLC (US) 2005-08-24 EP claimed
US-6642238-B2 Microbiocides against grampositive and gramnegative bacteria PHARMACIA AND UPJOHN COMPANY 2003-11-04 US claimed
EP-1263742-A1 OXAZOLIDINONE THIOAMIDES WITH PIPERAZINE AMIDE SUBSTITUENTS PHARMACIA & UPJOHN COMPANY (US) 2002-12-11 EP claimed
US-20020137754-A1 Microbiocides against grampositive and gramnegative bacteria PHARMACIA & UPJOHN COMPANY 2002-09-26 US claimed
US-20010047004-A1 Oxazolidinone thioamides with piperazine amide substituents PHARMACIA & UPJOHN COMPANY 2001-11-29 US claimed
WO-2001058885-A1 OXAZOLIDINONE THIOAMIDES WITH PIPERAZINE AMIDE SUBSTITUENTS PHARMACIA & UPJOHN COMPANY (US) 2001-08-16 WO claimed
US-7049443-B2 Amide-containing compound having improved solubility and method of improving the solubility of an amide-containing compound PHARMACIA & UPJOHN COMPANY (US) 2006-05-23 US disclosed
EP-1263742-B1 OXAZOLIDINONE THIOAMIDES WITH PIPERAZINE AMIDE SUBSTITUENTS PHARMACIA & UPJOHN CO LLC (US) 2005-08-24 EP disclosed
US-20040014967-A1 Amide-containing compound having improved solubility and method of improving the solubility of an amide-containing compound PHARMACIA & UPJOHN COMPANY 2004-01-22 US disclosed
US-6642238-B2 Microbiocides against grampositive and gramnegative bacteria PHARMACIA AND UPJOHN COMPANY 2003-11-04 US disclosed
EP-1263742-A1 OXAZOLIDINONE THIOAMIDES WITH PIPERAZINE AMIDE SUBSTITUENTS PHARMACIA & UPJOHN COMPANY (US) 2002-12-11 EP disclosed
US-20020137754-A1 Microbiocides against grampositive and gramnegative bacteria PHARMACIA & UPJOHN COMPANY 2002-09-26 US disclosed
US-20010047004-A1 Oxazolidinone thioamides with piperazine amide substituents PHARMACIA & UPJOHN COMPANY 2001-11-29 US disclosed
WO-2001058885-A1 OXAZOLIDINONE THIOAMIDES WITH PIPERAZINE AMIDE SUBSTITUENTS PHARMACIA & UPJOHN COMPANY (US) 2001-08-16 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 (3 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-20020137754-A1 Microbiocides against grampositive and gramnegative bacteria TLR1, MPO, TLR9 F10 4072/4885MAOB 1587/4885MAOA 1130/4885
US-20010047004-A1 Oxazolidinone thioamides with piperazine amide substituents OXA1L, HDAC1, TOP2A F10 4617/4885MAOB 4053/4885MAOA 3752/4885
US-20040014967-A1 Amide-containing compound having improved solubility and method of improving the solubility of an amide-containing compound AADAC, AAAS, SLC7A1 F10 2380/4885MAOB 732/4885MAOA 1179/4885

“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.