SCHEMBL17826615

SCHEMBL17826615

C=CCOP1(=S)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)C(O)C2O1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.69
▸ MEN1 O00255 1/20 0.69
▸ ALDH1A1 P00352 1/20 0.69
▸ RXFP1 Q9HBX9 2/20 0.65
▸ RAPGEF3 O95398 2/20 0.65
▸ STING1 Q86WV6 14/20 0.64
▸ LMNA P02545 2/20 0.64
▸ GMNN O75496 1/20 0.64
▸ BLM P54132 1/20 0.64
▸ NPSR1 Q6W5P4 1/20 0.64
▸ RAPGEF4 Q8WZA2 1/20 0.64

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
SCHEMBL16158834 0.87 KMT2A (0.51) KMT2AMEN1ALDH1A1RXFP1RAPGEF3
SCHEMBL1106673 0.86 KMT2A (0.76) KMT2AMEN1ALDH1A1RXFP1RAPGEF3
SCHEMBL15906324 0.86 KMT2A (0.76) KMT2AMEN1ALDH1A1RXFP1RAPGEF3
SCHEMBL10239446 0.86 KMT2A (0.76) KMT2AMEN1ALDH1A1RXFP1RAPGEF3
SCHEMBL1133093 0.86 KMT2A (0.76) KMT2AMEN1ALDH1A1RXFP1RAPGEF3
SCHEMBL10239451 0.84 RXFP1 (0.66) KMT2AMEN1ALDH1A1RXFP1RAPGEF3
SCHEMBL17826381 0.83 STING1 (0.67) STING1
SCHEMBL15865918 0.82 STING1 (0.60) KMT2AMEN1ALDH1A1RXFP1RAPGEF3
SCHEMBL1106664 0.82 KMT2A (1.00) KMT2AMEN1ALDH1A1RXFP1RAPGEF3
SCHEMBL10098850 0.82 KMT2A (1.00) KMT2AMEN1ALDH1A1RXFP1RAPGEF3

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
US-9365605-B2 Cyclic nucleotide analogs ALIOS BIOPHARMA, INC. (US) 2016-06-14 — — US disclosed
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