SCHEMBL31401856

SCHEMBL31401856

CC(C)C(=O)Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](OC(=O)c3ccccc3)[C@H]2F)c(=O)[nH]1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.52
▸ TAS1R3 Q7RTX0 2/20 0.46
▸ TAS1R1 Q7RTX1 2/20 0.46
▸ NT5E P21589 1/20 0.42
▸ TAAR1 Q96RJ0 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.39
▸ HINT1 P49773 1/20 0.39
▸ PNP P00491 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ P2RY11 Q96G91 1/20 0.38
▸ P2RX3 P56373 1/20 0.38
▸ P2RX4 Q99571 1/20 0.38
▸ P2RX2 Q9UBL9 1/20 0.38
▸ IMPDH2 P12268 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL29479237 0.92 KDM4E (0.53) KDM4ETAS1R3TAS1R1TAAR1HPGD
SCHEMBL24377105 0.88 KDM4E (0.49) KDM4ETAS1R3TAS1R1NT5ETAAR1
SCHEMBL29973219 0.88 KDM4E (0.49) KDM4ETAS1R3TAS1R1NT5ETAAR1
SCHEMBL25387607 0.88 KDM4E (0.49) KDM4ETAS1R3TAS1R1NT5ETAAR1
SCHEMBL24377219 0.88 KDM4E (0.49) KDM4ETAS1R3TAS1R1NT5ETAAR1
SCHEMBL25389665 0.88 KDM4E (0.49) KDM4ETAS1R3TAS1R1NT5ETAAR1
SCHEMBL12459063 0.86 MEN1 (0.51) KDM4ETAS1R3TAS1R1TAAR1ALDH1A1
SCHEMBL12582835 0.86 MEN1 (0.51) KDM4ETAS1R3TAS1R1TAAR1ALDH1A1
SCHEMBL2032731 0.86 MEN1 (0.51) KDM4ETAS1R3TAS1R1TAAR1ALDH1A1
SCHEMBL21073981 0.85 KDM4E (0.56) KDM4ETAS1R3TAS1R1NT5EHPGD

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-2025037891-A1 OLIGONUCLEOTIDE FOR 5'-CAPPED RNA SYNTHESIS 에스티팜 주식회사 2025-02-20 — — WO disclosed
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