SCHEMBL28970653

SCHEMBL28970653

O=C1c2[nH]cnc2NC(=S)[NH+]1[O-]

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GDA Q9Y2T3 2/20 0.36
ATIC P31939 1/20 0.35

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
SCHEMBL15759316 0.59 GDA (0.39) GDAATIC
SCHEMBL20213131 0.54 ALDH1A1 (0.30) ATIC
SCHEMBL10104693 0.53 ALDH1A1 (0.38) GDAATIC
SCHEMBL30523351 0.53 GDA (0.39) GDAATIC
SCHEMBL13735762 0.53 ALDH1A1 (0.65) GDAATIC
SCHEMBL12500558 0.51
SCHEMBL2523526 0.51 GDA (0.51) GDAATIC
SCHEMBL22647817 0.51 GDA (0.32) GDAATIC
SCHEMBL4502299 0.50
SCHEMBL10402532 0.49 ATIC (0.32) GDAATIC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115650967-A Organic luminescent material based on dicarbazole and thianthrene oxide group 西安交通大学 2023-01-31 CN disclosed