SCHEMBL30779382

SCHEMBL30779382

c1ccc2c(c1)Nc1cc3ccccc3cc1O2

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.68
HTR2B P41595 2/20 0.44
HTR7 P34969 1/20 0.44
MAPT P10636 4/20 0.44
GAA P10253 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
NPC1 O15118 1/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
NOX1 Q9Y5S8 1/20 0.44
DHODH Q02127 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL302837 1.00 ALOX5 (0.68) ALOX5HTR2BHTR7MAPTGAA
SCHEMBL22484791 0.92 ALOX5 (0.52) ALOX5HTR2BHTR7MAPTGAA
Bicarbonate SCHEMBL6265696 0.91 ALOX5 (0.62) ALOX5HTR2BHTR7MAPTGAA
Phenoxazine SCHEMBL6846406 0.90 ALOX5 (0.77) ALOX5HTR2BHTR7MAPTGAA
Phenoxazine SCHEMBL18770789 0.85 ALOX5 (0.85) ALOX5HTR2BHTR7MAPTGAA
SCHEMBL24141298 0.85 ALOX5 (0.53) ALOX5HTR2BHTR7MAPTGAA
Phenoxazine SCHEMBL29355714 0.82 ALOX5 (1.00) ALOX5HTR2BHTR7MAPTGAA
Phenoxazine SCHEMBL28844098 0.82 ALOX5 (1.00) ALOX5HTR2BHTR7MAPTGAA
Phenoxazine SCHEMBL6310178 0.82 ALOX5 (1.00) ALOX5HTR2BHTR7MAPTGAA
Phenoxazine SCHEMBL7862 0.82 ALOX5 (1.00) ALOX5HTR2BHTR7MAPTGAA

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 3 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-2024049878-A2 BIOREDUCIBLE POLYMER AND USE THEREOF THE JOHNS HOPKINS UNIVERSITY (US) 2024-03-07 WO disclosed
WO-2023245297-A1 FERROPTOSIS INHIBITORS AND USES THEREOF UNIVERSITY OF OTTAWA (CA) 2023-12-28 WO disclosed