SCHEMBL29268076

SCHEMBL29268076

Cn1ncc2cc(/C=N/[S+]([O-])C(C)(C)C)ncc21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.33
▸ MAPK1 P28482 2/20 0.32

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
SCHEMBL29988510 1.00 MAOB (0.33) MAOBMAPK1
SCHEMBL29268082 1.00 MAOB (0.33) MAOBMAPK1
SCHEMBL29268061 0.90 TTBK1 (0.32) MAOB
SCHEMBL29268063 0.90 TTBK1 (0.32) MAOB
SCHEMBL29989545 0.90 TTBK1 (0.32) MAOB
SCHEMBL29989128 0.84 POLB (0.33) —
SCHEMBL29268201 0.84 POLB (0.33) —
SCHEMBL29268198 0.84 POLB (0.33) —
SCHEMBL29989067 0.84 HTT (0.30) —
SCHEMBL30567630 0.84 HTT (0.30) —

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-116917289-A T-type calcium channel antagonists and uses thereof 小利兰·斯坦福大学董事会 2023-10-20 — — CN disclosed
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