SCHEMBL4480663

SCHEMBL4480663

C1=C2SCCNC2NC1

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
SCHEMBL16496273 0.64
SCHEMBL14919192 0.55
Ammonia Solution, Strong SCHEMBL13278678 0.53
SCHEMBL18263253 0.50
SCHEMBL940795 0.50
SCHEMBL9564511 0.46
SCHEMBL1626625 0.46 PRCP (0.45)
SCHEMBL213131 0.45 MAPT (0.38)
SCHEMBL3618802 0.43
SCHEMBL17533005 0.42

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
US-7579343-B2 Pyrrolo-thiazines and processes for the preparation and use thereof BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2009-08-25 US disclosed
EP-1934232-A2 PYRROLO-THIAZINES AND PROCESSES FOR THE PREPARATION AND USE THEREOF MICHIGAN STATE UNIVERSITY (US) 2008-06-25 EP disclosed
WO-2007030487-A2 PYRROLO-THIAZINES AND PROCESSES FOR THE PREPARATION AND USE THEREOF MICHIGAN STATE UNIVERSITY (US) 2007-03-15 WO disclosed
US-20070055062-A1 Pyrrolo-thiazines and processes for the preparation and use thereof BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2007-03-08 US disclosed