SCHEMBL28627472

SCHEMBL28627472

O=C1C(=O)c2ccc3ccccc3c2C=C1N1c2ccccc2Oc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 5/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ HPGD P15428 3/20 0.36
▸ GLA P06280 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HCRTR1 O43613 1/20 0.33
▸ ELANE P08246 1/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ HSD17B10 Q99714 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32

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
SCHEMBL29886157 0.69 P2RX4 (0.37) POLBMAPTALDH1A1MEN1LMNA
SCHEMBL18770825 0.68 POLB (0.52) POLBMAPTALDH1A1KDM4EHPGD
SCHEMBL30867065 0.68 POLB (0.52) POLBMAPTALDH1A1KDM4EHPGD
SCHEMBL28628168 0.68 POLB (0.41) POLBMAPTALDH1A1KDM4EGAA
SCHEMBL11790344 0.67 DNMT1 (0.49) DNMT1POLBMAPTALDH1A1HPGD
SCHEMBL28755138 0.67 DNMT1 (0.49) DNMT1MAPTALDH1A1KDM4EHPGD
SCHEMBL8210093 0.67 DNMT1 (0.49) DNMT1MAPTALDH1A1KDM4EHPGD
SCHEMBL29708071 0.67 DNMT1 (0.49) DNMT1MAPTALDH1A1KDM4EHPGD
SCHEMBL10959580 0.67 DNMT1 (0.49) DNMT1POLBMAPTALDH1A1KDM4E
SCHEMBL8650629 0.67 DNMT1 (0.49) DNMT1MAPTALDH1A1KDM4EHPGD

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
CN-109776535-B Orange light-red light material with planar structure, preparation method and application thereof in organic electroluminescent device 苏州大学 2021-09-10 — — CN disclosed
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