SCHEMBL15948747

SCHEMBL15948747

Nc1nc(Cl)c2ccn([C@@H]3O[C@H](CO)C[C@@H]3F)c2n1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 3/20 0.38
▸ NT5E P21589 4/20 0.37
▸ HDAC6 Q9UBN7 8/20 0.36
▸ HDAC1 Q13547 5/20 0.36
▸ HDAC4 P56524 4/20 0.36
▸ TLR7 Q9NYK1 2/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ TRAP1 Q12931 1/20 0.33
▸ METTL3 Q86U44 1/20 0.32

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
SCHEMBL14568627 0.86 NT5E (0.40) HSP90AA1NT5EHDAC6HDAC1HDAC4
SCHEMBL20692015 0.82 PRMT5 (0.44) METTL3
SCHEMBL10268781 0.81 TLR7 (0.48) TLR7
SCHEMBL8620551 0.80 NT5E (0.49) NT5E
SCHEMBL8620546 0.80 NT5E (0.49) NT5E
SCHEMBL14544484 0.78 ABL1 (0.43) HSP90AA1HDAC6HDAC1HDAC4TRAP1
SCHEMBL1738382 0.78 PDE2A (0.53) NT5EMETTL3
SCHEMBL1738386 0.78 PDE2A (0.53) NT5EMETTL3
SCHEMBL15948682 0.78 NT5E (0.42) HSP90AA1NT5EHDAC6
SCHEMBL9127612 0.77 METTL3 (0.37) NT5EMETTL3

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-2014124430-A1 NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2014-08-14 — — WO disclosed
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