SCHEMBL17461708

SCHEMBL17461708

CC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H](OC)C1O[PH](=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 3/20 0.54
▸ ADORA1 P30542 3/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ DNPH1 O43598 1/20 0.51
▸ PRKAB2 O43741 1/20 0.51
▸ TRPM2 O94759 1/20 0.51
▸ LDHA P00338 1/20 0.51
▸ ADRB2 P07550 1/20 0.51
▸ FBP1 P09467 1/20 0.51
▸ SRC P12931 1/20 0.51
▸ P2RY2 P41231 1/20 0.51
▸ P2RY1 P47900 1/20 0.51
▸ PRKAG1 P54619 1/20 0.51
▸ PRKAA2 P54646 1/20 0.51
▸ PDE4D Q08499 1/20 0.51
▸ KCNH2 Q12809 1/20 0.51
▸ PRKAA1 Q13131 1/20 0.51
▸ PDE3A Q14432 1/20 0.51
▸ TAS1R3 Q7RTX0 1/20 0.51
▸ TAS1R1 Q7RTX1 1/20 0.51

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
SCHEMBL25098311 0.93 ADORA1 (0.60) ADORA3ADORA1SMN1; SMN2DNPH1PRKAB2
SCHEMBL25097805 0.93 ADORA1 (0.60) ADORA3ADORA1SMN1; SMN2DNPH1PRKAB2
SCHEMBL12087515 0.89 ADORA3 (0.57) ADORA3ADORA1SMN1; SMN2ADORA2BGAA
SCHEMBL16587637 0.89 ADORA3 (0.57) ADORA3ADORA1SMN1; SMN2ADORA2BGAA
SCHEMBL12015137 0.89 ADORA3 (0.57) ADORA3ADORA1SMN1; SMN2ADORA2BGAA
SCHEMBL8418063 0.87 ADORA1 (0.64) ADORA3ADORA1SMN1; SMN2DNPH1PRKAB2
SCHEMBL20329201 0.86 ADORA1 (0.59) ADORA3ADORA1SMN1; SMN2DNPH1PRKAB2
SCHEMBL23665576 0.85 GAA (0.64) ADORA3ADORA1SMN1; SMN2DNPH1PRKAB2
SCHEMBL19884375 0.85 ADORA3 (0.53) ADORA3ADORA1SMN1; SMN2ADORA2BGAA
SCHEMBL24943281 0.85 GAA (0.58) ADORA3ADORA1SMN1; SMN2DNPH1PRKAB2

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-2386636-B1 ENA NUCLEIC ACID DRUGS MODIFYING SPLICING IN MRNA PRECURSOR MATSUO MASAFUMI (JP) 2016-01-27 — — EP disclosed
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