SCHEMBL28449520

SCHEMBL28449520

C=CCc1nc2ccccc2[nH]c1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 12/20 0.64
▸ ALDH1A1 P00352 10/20 0.60
▸ HSD17B10 Q99714 5/20 0.60
▸ HPGD P15428 4/20 0.60
▸ HTT P42858 2/20 0.60
▸ GAA P10253 2/20 0.60
▸ NPC1 O15118 5/20 0.59
▸ RAB9A P51151 5/20 0.59
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ MEN1 O00255 5/20 0.55
▸ KMT2A Q03164 5/20 0.55
▸ MAPT P10636 4/20 0.55
▸ POLB P06746 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ PLAUR Q03405 1/20 0.51
▸ KHK P50053 1/20 0.51
▸ PKM P14618 1/20 0.50
▸ LMNA P02545 1/20 0.49
▸ TP53 P04637 1/20 0.49
▸ ALOX15 P16050 1/20 0.49

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
SCHEMBL28135101 0.81 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDHTT
SCHEMBL5798718 0.81 KDM4E (0.60) KDM4EALDH1A1HSD17B10HPGDHTT
SCHEMBL13694770 0.78 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDHTT
SCHEMBL30164086 0.78 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDHTT
SCHEMBL1905589 0.78 KDM4E (1.00) KDM4EALDH1A1HSD17B10HPGDHTT
SCHEMBL29232559 0.78 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDHTT
SCHEMBL1161820 0.78 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDHTT
SCHEMBL29992538 0.78 KDM4E (1.00) KDM4EALDH1A1HSD17B10HPGDHTT
SCHEMBL463268 0.76 DDAH1 (0.59) ALDH1A1HSD17B10HPGDGAANPC1
SCHEMBL6490997 0.75 KDM4E (1.00) KDM4EALDH1A1HSD17B10HPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110117260-B Preparation method of 3-alkyl quinoxaline-2 (1H) -ketone compound 湖南科技学院 2020-12-25 — — CN claimed
CN-111635370-A Photocatalytic preparation method of 3-alkyl quinoxalinone derivative 河南工业大学 2020-09-08 — — CN claimed
CN-119913525-A Electrochemical synthesis method of 3-aryl quinoxalinone compound 新疆大学 2025-05-02 — — CN disclosed
CN-116120246-A 3-butyl-2 (1H) quinoxalinone compound and preparation method thereof 常州大学 2023-05-16 — — CN disclosed
CN-110117260-B Preparation method of 3-alkyl quinoxaline-2 (1H) -ketone compound 湖南科技学院 2020-12-25 — — CN disclosed
CN-111635370-A Photocatalytic preparation method of 3-alkyl quinoxalinone derivative 河南工业大学 2020-09-08 — — CN disclosed
CN-111635370-A Photocatalytic preparation method of 3-alkyl quinoxalinone derivative 河南工业大学 2020-09-08 — — CN disclosed
CN-111635370-A Photocatalytic preparation method of 3-alkyl quinoxalinone derivative 河南工业大学 2020-09-08 — — CN disclosed
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