SCHEMBL5216980

SCHEMBL5216980

O=C(O)NC[C@H]1CN(c2ccc(N3CCSCC3)cc2)C(=O)O1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.60
MAOB P27338 1/20 0.60
F10 P00742 19/20 0.58
F2 P00734 2/20 0.56
ITGB3 P05106 6/20 0.51
ITGA2B P08514 6/20 0.51
PRSS1 P07477 2/20 0.51
PRSS2 P07478 2/20 0.51
PRSS3 P35030 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51

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
SCHEMBL7156718 0.87 MAOA (0.57) MAOAMAOBF10F2ITGB3
SCHEMBL8500683 0.86 MAOA (0.56) MAOAMAOBF10F2ITGB3
SCHEMBL7156712 0.86 MAOA (0.64) MAOAMAOBF10F2ITGB3
SCHEMBL8500680 0.86 MAOA (0.56) MAOAMAOBF10F2ITGB3
SCHEMBL7156723 0.86 MAOA (0.64) MAOAMAOBF10F2ITGB3
SCHEMBL8448606 0.86 MAOA (0.56) MAOAMAOBF10F2ITGB3
SCHEMBL5216684 0.85 MAOB (0.84) MAOAMAOBF10
SCHEMBL7949971 0.84 F10 (0.57) MAOAMAOBF10F2ITGB3
SCHEMBL7955642 0.84 MAOB (0.56) MAOAMAOBF10F2ITGB3
SCHEMBL7157295 0.84 MAOA (0.59) MAOAMAOBF10F2ITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1467992-B1 ANTIMICROBIAL DIHYDROTHIAZINE AND DIHYDROTHIOPYRAN OXAZOLIDINONES PHARMACIA & UPJOHN CO LLC (US) 2007-08-08 EP disclosed
US-7101874-B2 Antimicrobial dihydrothiazine and dihydrothiopyran oxazolidinones PHARMACIA AND UPJOHN COMPANY (US) 2006-09-05 US disclosed
US-20050143376-A1 Antimicrobial dihydrothiazine and dihydrothiopyran oxazolidinones GORDEEV MIKHAIL F (US) 2005-06-30 US disclosed
US-6884813-B2 Antimicrobial dihydrothiazine and dihydrothiopyran oxazolidinones PHARMACIA & UPJOHN COMPANY (US) 2005-04-26 US disclosed
US-20030232812-A1 Antimicrobial dihydrothiazine and dihydrothiopyran oxazolidinones PHARMACIA & UPJOHN COMPANY 2003-12-18 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 (2 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-20050143376-A1 Antimicrobial dihydrothiazine and dihydrothiopyran oxazolidinones DHX35, DHX15, OXA1L MAOA 3852/4885MAOB 3530/4885F10 1666/4885
US-20030232812-A1 Antimicrobial dihydrothiazine and dihydrothiopyran oxazolidinones DHX35, ZYX, DHX15 MAOA 3803/4885MAOB 3725/4885F10 1689/4885

“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.