SCHEMBL24418856

SCHEMBL24418856

CC(C)[C@@H](N)C(=O)OC[C@H]1O[C@@H](c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SLC5A1 P13866 1/20 0.41
▸ SLC5A2 P31639 1/20 0.41
▸ POLRMT O00411 1/20 0.39
▸ IARS1 P41252 3/20 0.39
▸ MARS1 P56192 3/20 0.38
▸ LARS1 Q9P2J5 1/20 0.38
▸ DOT1L Q8TEK3 2/20 0.36
▸ GSK3A P49840 1/20 0.35
▸ RPS6KA3 P51812 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ TARS1 P26639 2/20 0.34
▸ ADK P55263 1/20 0.34

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
SCHEMBL26832023 0.87 POLRMT (0.40) POLRMTMARS1DOT1LGSK3ARPS6KA3
SCHEMBL26832290 0.87 POLRMT (0.39) POLRMTMARS1DOT1LGSK3ARPS6KA3
SCHEMBL25913394 0.85 POLRMT (0.36) POLRMTMARS1DOT1LGSK3ARPS6KA3
SCHEMBL26149119 0.85 POLRMT (0.40) POLRMTMARS1DOT1LGSK3ARPS6KA3
SCHEMBL26319911 0.84 POLRMT (0.37) SLC5A1SLC5A2POLRMTIARS1MARS1
SCHEMBL26148725 0.84 POLRMT (0.39) POLRMTMARS1DOT1LGSK3ARPS6KA3
SCHEMBL26832481 0.83 POLRMT (0.38) SLC5A1SLC5A2POLRMTIARS1MARS1
SCHEMBL26832176 0.83 POLRMT (0.39) SLC5A1SLC5A2POLRMTMARS1DOT1L
SCHEMBL26398893 0.83 POLRMT (0.36) SLC5A1SLC5A2POLRMTMARS1DOT1L
SCHEMBL26229817 0.80 POLRMT (0.46) POLRMTDOT1L

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-2022098371-A1 PRODRUGS OF 1'-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGUES FOR ANTIVIRAL TREATMENT YAN MATTHEW (US) 2022-05-12 — — WO disclosed
Send feedback