SCHEMBL30811565

SCHEMBL30811565

FC(F)(F)c1ccc2c(c1)Sc1ccccc1N2

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 11/20 0.84
CYBB P04839 2/20 0.84
NOX3 Q9HBY0 2/20 0.84
NOX4 Q9NPH5 2/20 0.84
MAPT P10636 7/20 0.61
GAA P10253 6/20 0.61
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
SNCA P37840 3/20 0.61
ALOX15 P16050 3/20 0.61
TDP1 Q9NUW8 2/20 0.61
BCHE P06276 2/20 0.61
ACHE P22303 2/20 0.61
CYP1A2 P05177 2/20 0.61
POLB P06746 1/20 0.61
CYP3A4 P08684 1/20 0.61
ADORA3 P0DMS8 1/20 0.61
ALOX12 P18054 1/20 0.61
MAOA P21397 1/20 0.61
CNR1 P21554 1/20 0.61

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
SCHEMBL10372692 1.00 NOX1 (0.84) NOX1CYBBNOX3NOX4MAPT
Phenothiazine SCHEMBL6532335 0.91 NOX1 (1.00) NOX1CYBBNOX3NOX4MAPT
SCHEMBL560225 0.91 NOX1 (1.00) NOX1CYBBNOX3NOX4MAPT
SCHEMBL29475150 0.91 NOX1 (1.00) NOX1CYBBNOX3NOX4MAPT
SCHEMBL20842835 0.91 NOX1 (0.68) NOX1CYBBNOX3NOX4MAPT
Benzene SCHEMBL29242186 0.90 NOX1 (0.97) NOX1CYBBNOX3NOX4MAPT
SCHEMBL1719191 0.84 NOX1 (0.62) NOX1CYBBNOX3NOX4MAPT
SCHEMBL1855582 0.83 NOX1 (0.83) NOX1CYBBNOX3NOX4MAPT
SCHEMBL9007315 0.81 NOX1 (0.66) NOX1CYBBNOX3NOX4MAPT
SCHEMBL8879904 0.81 NOX1 (0.66) NOX1CYBBNOX3NOX4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4543863-A1 FERROPTOSIS INHIBITORS AND USES THEREOF University Of Ottawa (CA) 2025-04-30 EP disclosed
WO-2023245297-A1 FERROPTOSIS INHIBITORS AND USES THEREOF UNIVERSITY OF OTTAWA (CA) 2023-12-28 WO disclosed