SCHEMBL9557447

SCHEMBL9557447

NC1(N)C=CNC(=O)N1

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
SCHEMBL7064203 0.76
SCHEMBL2516164 0.75
SCHEMBL30836898 0.72
SCHEMBL21990303 0.63
SCHEMBL2489548 0.56
SCHEMBL11336911 0.51
SCHEMBL2873513 0.47
SCHEMBL616019 0.47
SCHEMBL19747799 0.46
SCHEMBL13954334 0.46

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5210203-A Sulfonamide-derivative compounds for tagging nucleic acid probes SISKA DIAGNOSTICS, INC. (US) 1993-05-11 US disclosed
US-5130446-A Derivatives of fluoroscein or rhodamine SISKA DIAGNOSTICS, INC. (US) 1992-07-14 US disclosed
US-4833251-A FLUORESCENT COMPOUNDS SISKA DIAGNOSTICS, INC. (US) 1989-05-23 US disclosed
US-4780405-A Carbonic anhydrase inhibitor-tagged nucleic acid probes SISKA DIAGNOSTICS, INC. (US) 1988-10-25 US disclosed
EP-0209996-A2 Nucleic acid probes comprising N4 -(substituted amino)cytidines SISKA DIAGNOSTICS,INC. (US) 1987-01-28 EP disclosed
EP-0210021-A2 Carbonic anhydrase inhibitor-tagged nucleic acid probes SISKA DIAGNOSTICS,INC. (US) 1987-01-28 EP disclosed