SCHEMBL30222271

SCHEMBL30222271

O=C1C=C(O)C(=O)c2c1ccc1ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 1/20 0.56
▸ NSD2 O96028 1/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ OPRD1 P41143 1/20 0.51
▸ HKDC1 Q2TB90 1/20 0.51
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ HPGD P15428 2/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ CYP1A2 P05177 2/20 0.47
▸ USP2 O75604 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ ALOX12 P18054 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ MAPT P10636 4/20 0.45

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
SCHEMBL9350222 1.00 DNMT1 (0.56) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL8205668 0.86 DNMT1 (0.51) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL9350950 0.83 NSD2 (0.59) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL19230419 0.79 DNMT1 (0.83) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL7122517 0.77 DNMT1 (0.73) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL16144677 0.77 DNMT1 (0.80) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL9900718 0.75 DNMT1 (0.70) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL8210093 0.74 DNMT1 (0.49) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL16144669 0.74 DNMT1 (0.68) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL3331917 0.73 MAPT (0.41) NSD2OPRM1OPRD1HKDC1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115874201-B Electrosynthesis method of furanquinone 南京工业大学 2025-02-25 — — CN disclosed
CN-116240560-A Method for electrochemically synthesizing furoquinone by utilizing microchannel reactor 南京工业大学 2023-06-09 — — CN disclosed
CN-115874201-A Electric synthesis method of furan quinone 南京工业大学 2023-03-31 — — CN disclosed
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