SCHEMBL14430846

SCHEMBL14430846

CCCCOC1[C@H]2OC[C@@]1(COC(=O)c1ccccc1)O[C@H]2n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 1/20 0.43
▸ GSK3A P49840 2/20 0.42
▸ RPS6KA3 P51812 2/20 0.42
▸ MAPK14 Q16539 2/20 0.42
▸ TAAR1 Q96RJ0 2/20 0.42
▸ HINT1 P49773 6/20 0.41
▸ TAS1R3 Q7RTX0 1/20 0.41
▸ TAS1R1 Q7RTX1 1/20 0.41
▸ HPGD P15428 1/20 0.40
▸ STING1 Q86WV6 2/20 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
SCHEMBL14931023 1.00 PNP (0.43) PNPGSK3ARPS6KA3MAPK14TAAR1
SCHEMBL3029887 0.90 HINT1 (0.48) PNPGSK3ARPS6KA3MAPK14TAAR1
SCHEMBL9962903 0.89 GSK3A (0.40) GSK3ARPS6KA3MAPK14STING1
SCHEMBL14536784 0.89 GSK3A (0.40) GSK3ARPS6KA3MAPK14STING1
SCHEMBL13747670 0.87 ADORA3 (0.34) HINT1STING1
SCHEMBL17410063 0.86 ADORA2B (0.34) HINT1STING1
SCHEMBL14930904 0.86 HPGD (0.45) PNPHINT1HPGDSTING1
SCHEMBL18573929 0.85 PNP (0.47) PNPGSK3ARPS6KA3MAPK14TAAR1
SCHEMBL14931022 0.84 HINT1 (0.43) HINT1HPGDSTING1
SCHEMBL9962904 0.83 TYMP (0.37) STING1

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
EP-1501848-B1 SYNTHESIS OF LOCKED NUCLEIC ACID DERIVATIVES SANTARIS PHARMA AS (DK) 2007-08-08 — — EP disclosed
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