SCHEMBL31265053

SCHEMBL31265053

COc1ccc2c(c1)c1cc(OC)ccc1n2CCCOP(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 3/20 0.52
▸ MAOB P27338 3/20 0.52
▸ GRIN1 Q05586 1/20 0.50
▸ GRIN2A Q12879 1/20 0.50
▸ GRIN2B Q13224 1/20 0.50
▸ KDM4E B2RXH2 3/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ PTGER4 P35408 1/20 0.45
▸ PLA2G2A P14555 3/20 0.44
▸ PGR P06401 2/20 0.43
▸ RORA P35398 1/20 0.43
▸ RORC P51449 1/20 0.43
▸ RORB Q92753 1/20 0.43
▸ HASPIN Q8TF76 1/20 0.43
▸ DYRK2 Q92630 1/20 0.43
▸ CNR2 P34972 2/20 0.43
▸ CNR1 P21554 1/20 0.43
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ MAPT P10636 2/20 0.42

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
SCHEMBL29111466 0.96 MAOA (0.54) MAOAMAOBGRIN1GRIN2AGRIN2B
SCHEMBL30516713 0.96 MAOA (0.54) MAOAMAOBGRIN1GRIN2AGRIN2B
SCHEMBL31265057 0.95 MAOA (0.56) MAOAMAOBGRIN1GRIN2AGRIN2B
SCHEMBL29085484 0.92 MAOA (0.48) MAOAMAOBGRIN1GRIN2AGRIN2B
SCHEMBL30516714 0.92 MAOA (0.48) MAOAMAOBGRIN1GRIN2AGRIN2B
SCHEMBL30516717 0.86 PTGER4 (0.42) MAOAMAOBGRIN1GRIN2AGRIN2B
SCHEMBL30516715 0.85 PTGER4 (0.46) MAOAMAOBGRIN1GRIN2AGRIN2B
SCHEMBL31265065 0.83 RORA (0.46) KDM4EHSD17B10PTGER4PGRRORA
SCHEMBL30491695 0.82 MAOA (0.56) MAOAMAOBGRIN1GRIN2AGRIN2B
SCHEMBL26597789 0.82 MAOA (0.56) MAOAMAOBGRIN1GRIN2AGRIN2B

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
CN-119136623-A Preparation method of self-assembled monolayer in perovskite battery 无锡永珈光能科技有限公司 2024-12-13 — — CN claimed
CN-119136623-A Preparation method of self-assembled monolayer in perovskite battery 无锡永珈光能科技有限公司 2024-12-13 — — CN disclosed
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