SCHEMBL7653464

SCHEMBL7653464

[S]SN1C=CC=CC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL9832229 0.74
SCHEMBL4155922 0.74
SCHEMBL10416682 0.70
SCHEMBL3648895 0.63
SCHEMBL589950 0.61
SCHEMBL989420 0.57
SCHEMBL1327501 0.57
Hydrochloric Acid SCHEMBL1071446 0.57
SCHEMBL8052784 0.57
SCHEMBL123491 0.57

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-0787015-B1 SYNTHESIS OF TYPHOID FEVER VACCINE FROM A PLANT OR FRUIT POLYSACCHARIDE US GOV HEALTH & HUMAN SERV (US) 2002-02-27 EP disclosed
US-5738855-A O-ACETYLATING A PLANT, FRUIT OR SYNTHETIC OLIGO OR POLYGALACTURONATE, CONJUGATING THE MODIFIED PLANT, FRUIT OR POLY OR OLIGOGALACTURONATE TO A CARRIER WHICH IS IMMUNOGENIC AGAINST SALMONELLA TYPHI THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-04-14 US disclosed
EP-0787015-A1 SYNTHESIS OF TYPHOID FEVER VACCINE FROM A PLANT OR FRUIT POLYSACCHARIDE THE GOVERNMENT OF THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-08-06 EP disclosed
WO-1996011709-A1 SYNTHESIS OF TYPHOID FEVER VACCINE FROM A PLANT OR FRUIT POLYSACCHARIDE THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-04-25 WO disclosed