SCHEMBL25052876

SCHEMBL25052876

c1ccc2c(c1)oc1c2ccc2c3cc(-c4ccc5cc(-c6ccc7c8ccccc8c8ccccc8c7c6)ccc5c4)ccc3oc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
MAPT P10636 4/20 0.42
NPC1 O15118 3/20 0.42
KDM4E B2RXH2 3/20 0.42
HPGD P15428 3/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CASP3 P42574 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
PLA2G2A P14555 3/20 0.40
PLA2G4A P47712 3/20 0.40
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
AHR P35869 3/20 0.39
HCRTR1 O43613 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL25052682 0.98 PLA2G2A (0.42) ALOX5MAPTNPC1KDM4EHPGD
SCHEMBL25052686 0.98 PLA2G2A (0.42) ALOX5MAPTNPC1KDM4EHPGD
SCHEMBL25050917 0.97 CYP1A1 (0.43) ALOX5MAPTNPC1KDM4EHPGD
SCHEMBL25052683 0.95 PLA2G2A (0.45) ALOX5MAPTNPC1KDM4EHPGD
SCHEMBL25052684 0.95 ALOX5 (0.42) ALOX5MAPTNPC1KDM4EHPGD
SCHEMBL25052872 0.94 CYP1A1 (0.42) ALOX5MAPTNPC1KDM4EHPGD
SCHEMBL25052552 0.93 ALOX5 (0.47) ALOX5MAPTNPC1KDM4EHPGD
SCHEMBL25052359 0.93 PLA2G2A (0.43) ALOX5MAPTNPC1KDM4EHPGD
SCHEMBL1637009 0.92 ALOX5 (0.44) ALOX5MAPTNPC1KDM4EHPGD
SCHEMBL25052548 0.92 PLA2G2A (0.46) ALOX5MAPTNPC1KDM4EHPGD

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-20230050369-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOUND AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-02-16 US disclosed