SCHEMBL24314853

SCHEMBL24314853

N/C(=N\C(=N/Cc1cccc2oc3cc(-c4ccc5ccccc5c4)ccc3c12)c1ccccc1)c1ccc2ccccc2c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 4/20 0.43
GRIN2B Q13224 4/20 0.43
HTR2B P41595 1/20 0.34
S1PR5 Q9H228 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
MMP12 P39900 1/20 0.30
MMP13 P45452 1/20 0.30
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 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
SCHEMBL24315602 0.94 GRIN2B (0.41) GRIN1GRIN2BHTR2BMMP12MMP13
SCHEMBL24315350 0.92 GRIN2B (0.44) GRIN1GRIN2BHTR2B
SCHEMBL25653733 0.92 GRIN2B (0.35) GRIN1GRIN2BHTR2BMMP12MMP13
SCHEMBL26068028 0.91 GRIN1 (0.40) GRIN1GRIN2BHTR2BMMP12MMP13
SCHEMBL24314844 0.91 HTR2B (0.34) GRIN1GRIN2BHTR2BMMP12MMP13
SCHEMBL24315035 0.89 GRIN2B (0.39) GRIN1GRIN2BHTR2BS1PR5
SCHEMBL25652326 0.88 GRIN1 (0.37) GRIN1GRIN2BHTR2BS1PR5
SCHEMBL26371737 0.87 GRIN1 (0.37) GRIN1GRIN2BHTR2BS1PR5
SCHEMBL26283753 0.87 GRIN2B (0.45) GRIN1GRIN2BHTR2BCYP1A2CYP2D6
SCHEMBL23822478 0.86 HTR2B (0.36) GRIN1GRIN2BHTR2BMMP12MMP13

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-3972001-B1 ORGANIC LIGHT EMITTING DEVICE LG CHEMICAL LTD (KR) 2023-06-21 EP disclosed
EP-3972001-A1 ORGANIC LIGHT EMITTING DEVICE LG Chem, Ltd. (KR) 2022-03-23 EP disclosed