SCHEMBL25652005

SCHEMBL25652005

N/C(=N\C(=N/Cc1cccc2oc3ccc(-c4cccc5oc6ccccc6c45)cc3c12)c1ccccc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.35
HTR2B P41595 1/20 0.33
IDO1 P14902 1/20 0.33
BACE1 P56817 1/20 0.32
PLA2G2A P14555 1/20 0.30
PLA2G4A P47712 1/20 0.30
ALOX5 P09917 1/20 0.30
CHEK2 O96017 1/20 0.30

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
SCHEMBL24314978 0.97 BACE1 (0.33) GRIN2BHTR2BIDO1BACE1ALOX5
SCHEMBL24658273 0.92 GRIN2B (0.39) GRIN2BHTR2BIDO1PLA2G2APLA2G4A
SCHEMBL25651632 0.92 HTR2B (0.33) GRIN2BHTR2BIDO1PLA2G2APLA2G4A
SCHEMBL24314408 0.91 GRIN2B (0.37) GRIN2BHTR2BIDO1PLA2G2APLA2G4A
SCHEMBL25652287 0.91 GRIN2B (0.31) GRIN2BHTR2BALOX5
SCHEMBL26067605 0.90 GRIN1 (0.33) GRIN2BHTR2BBACE1
SCHEMBL26067244 0.90 GRIN1 (0.33) GRIN2BHTR2BIDO1BACE1CHEK2
SCHEMBL23820565 0.89 HTR2B (0.31) HTR2BIDO1ALOX5
SCHEMBL24314941 0.89 IDO1 (0.38) GRIN2BHTR2BIDO1PLA2G2APLA2G4A
SCHEMBL26371737 0.88 GRIN1 (0.37) GRIN2BHTR2BIDO1BACE1

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
EP-3972001-B1 ORGANIC LIGHT EMITTING DEVICE LG CHEMICAL LTD (KR) 2023-06-21 EP disclosed