SCHEMBL24193387

SCHEMBL24193387

O=c1nc2n(CC(O)C[C@@H](O)CO)c3cc(O)ccc3cc-2c(=O)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP2 O95551 13/20 0.46
▸ KDM4E B2RXH2 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ MEN1 O00255 3/20 0.40
▸ USP2 O75604 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ ALPL P05186 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ ALPI P09923 1/20 0.40
▸ ALPG P10696 1/20 0.40
▸ AGTR1 P30556 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ HAT1 O14929 2/20 0.39
▸ RBBP7 Q16576 2/20 0.39
▸ CASP1 P29466 2/20 0.39
▸ BRCA1 P38398 2/20 0.39
▸ RECQL P46063 2/20 0.39

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
SCHEMBL21524607 0.79 MEN1 (0.45) TDP2KDM4EALDH1A1HPGDHTT
SCHEMBL19424100 0.71 MEN1 (0.74) TDP2KDM4EALDH1A1HPGDHTT
SCHEMBL20155598 0.71 MEN1 (0.74) TDP2KDM4EALDH1A1HPGDHTT
SCHEMBL24201806 0.71 MEN1 (0.74) TDP2KDM4EALDH1A1HPGDHTT
SCHEMBL21524602 0.67 KDM4E (0.60) TDP2KDM4EALDH1A1HPGDHTT
SCHEMBL21524599 0.67 MEN1 (0.80) TDP2KDM4EALDH1A1HPGDHTT
SCHEMBL14816849 0.66 MEN1 (0.59) TDP2KDM4EALDH1A1HPGDHTT
SCHEMBL11304892 0.64 KDM4E (0.46) TDP2KDM4EALDH1A1HPGDHTT
SCHEMBL11384276 0.64 TDP1 (0.55) KDM4EALDH1A1HPGDHTTGAA
SCHEMBL13496315 0.63 KMT2A (0.55) TDP2KDM4EALDH1A1HPGDHTT

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
WO-2022010386-A1 USE OF COFACTOR FO AND ANALOGUES THEREOF AS A BIOLUMINESCENCE REACTION COMPONENT ЯМПОЛЬСКИЙ, Илья Викторович 2022-01-13 — — WO disclosed
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