SCHEMBL24512508

SCHEMBL24512508

CC(C)C(=O)Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@H](I)C2O[Si](C)(C)C(C)(C)C)c(=O)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.54
▸ TAS1R3 Q7RTX0 1/20 0.46
▸ TAS1R1 Q7RTX1 1/20 0.46
▸ HPGD P15428 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ POLA1 P09884 1/20 0.37
▸ HINT1 P49773 3/20 0.37
▸ STING1 Q86WV6 1/20 0.36
▸ IMPDH2 P12268 2/20 0.36
▸ IMPDH1 P20839 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA2B P29275 1/20 0.36

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
SCHEMBL24512723 1.00 KDM4E (0.54) KDM4ETAS1R3TAS1R1HPGDALDH1A1
SCHEMBL24181915 0.93 KDM4E (0.56) KDM4ETAS1R3TAS1R1HPGDALDH1A1
SCHEMBL26347587 0.93 KDM4E (0.56) KDM4ETAS1R3TAS1R1HPGDALDH1A1
SCHEMBL24512468 0.92 KDM4E (0.48) KDM4ETAS1R3TAS1R1HPGDALDH1A1
SCHEMBL24512513 0.92 KDM4E (0.48) KDM4ETAS1R3TAS1R1HPGDALDH1A1
SCHEMBL26808496 0.92 KDM4E (0.56) KDM4ETAS1R3TAS1R1HPGDALDH1A1
SCHEMBL12714813 0.91 KDM4E (0.55) KDM4ETAS1R3TAS1R1HPGDALDH1A1
SCHEMBL6397986 0.91 KDM4E (0.55) KDM4ETAS1R3TAS1R1HPGDALDH1A1
SCHEMBL6397981 0.91 KDM4E (0.55) KDM4ETAS1R3TAS1R1HPGDALDH1A1
SCHEMBL21566437 0.91 KDM4E (0.54) KDM4ETAS1R3TAS1R1HPGDALDH1A1

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-2022123501-A1 PROTECTED DEOXYDIDEHYDRO-NUCLEOSIDES VICTORIA LINK LIMITED (NZ) 2022-06-16 — — WO disclosed
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