Pyritidium

Pyritidium

SCHEMBL29387282

Cc1cc(Nc2ccc3c(c2)c(-c2ccc(N)cc2)[n+](C)c2cc(N)ccc32)nc(N)[n+]1C

nearest known ligand 0.49

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
BLM P54132 4/20 0.49
APAF1 O14727 1/20 0.49
NPC1 O15118 1/20 0.49
POLB P06746 1/20 0.49
RAB9A P51151 1/20 0.49
TERT O14746 6/20 0.38
KDM4E B2RXH2 4/20 0.35
CYP3A4 P08684 4/20 0.35
MAPT P10636 4/20 0.35
CASP1 P29466 4/20 0.35
CASP7 P55210 4/20 0.35
THRB P10828 3/20 0.35
HPGD P15428 3/20 0.35
RECQL P46063 3/20 0.35
LMNA P02545 3/20 0.35
BRCA1 P38398 3/20 0.35
HTT P42858 3/20 0.35
SMN1; SMN2 Q16637 3/20 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
Pyritidium SCHEMBL30468818 0.99 MEN1 (0.51) MEN1KMT2ABLMAPAF1NPC1
Pyritidium SCHEMBL2732830 0.99 MEN1 (0.51) MEN1KMT2ABLMAPAF1NPC1
Pyritidium SCHEMBL7636972 0.97 MEN1 (0.49) MEN1KMT2ABLMAPAF1NPC1
SCHEMBL291198 0.73 TERT (0.67) MEN1KMT2ABLMNPC1RAB9A
Sulfuric Acid SCHEMBL8658789 0.68 TERT (0.59) MEN1KMT2ABLMTERTALOX15
SCHEMBL2014260 0.68 MEN1 (0.97) MEN1KMT2ABLMAPAF1NPC1
SCHEMBL26848576 0.68 MEN1 (0.97) MEN1KMT2ABLMAPAF1NPC1
Iodide SCHEMBL9380644 0.68 ROCK1 (0.52) MEN1KMT2ANPC1POLBRAB9A
Bromide SCHEMBL592713 0.67 MEN1 (1.00) MEN1KMT2ABLMAPAF1NPC1
SCHEMBL7762151 0.67 MEN1 (0.94) MEN1KMT2ABLMAPAF1NPC1

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
US-20220047505-A1 Controlled Absorption Water-Soluble Pharmaceutically Active Organic Compound Formulation for Once-Daily Administration STI PHARMA, LLC (US) 2022-02-17 US disclosed