SCHEMBL18744138

SCHEMBL18744138

CP1(=O)OC[C@H]2O[C@@H](n3cnc4c(N)ncnc43)[C@@H](O)[C@@H]2O1

nearest known ligand 0.80

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 14/20 0.80
▸ LMNA P02545 2/20 0.80
▸ RAPGEF3 O95398 2/20 0.80
▸ KMT2A Q03164 2/20 0.80
▸ GMNN O75496 1/20 0.80
▸ BLM P54132 1/20 0.80
▸ NPSR1 Q6W5P4 1/20 0.80
▸ RAPGEF4 Q8WZA2 1/20 0.80
▸ RXFP1 Q9HBX9 2/20 0.79
▸ MEN1 O00255 1/20 0.74
▸ ALDH1A1 P00352 1/20 0.74

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
SCHEMBL23747296 0.91 STING1 (0.81) STING1LMNARAPGEF3KMT2AGMNN
SCHEMBL24601699 0.91 STING1 (0.69) STING1LMNARAPGEF3KMT2AGMNN
Cyclic Adenosine Monophosphate SCHEMBL23829820 0.89 STING1 (1.00) STING1LMNARAPGEF3KMT2AGMNN
Cyclic Adenosine Monophosphate SCHEMBL20912149 0.89 STING1 (1.00) STING1LMNARAPGEF3KMT2AGMNN
Cyclic Adenosine Monophosphate SCHEMBL18311520 0.89 STING1 (1.00) STING1LMNARAPGEF3KMT2AGMNN
Cyclic Adenosine Monophosphate SCHEMBL23829670 0.89 STING1 (1.00) STING1LMNARAPGEF3KMT2AGMNN
Cyclic Adenosine Monophosphate SCHEMBL23829591 0.89 STING1 (1.00) STING1LMNARAPGEF3KMT2AGMNN
Cyclic Adenosine Monophosphate SCHEMBL23829653 0.89 STING1 (1.00) STING1LMNARAPGEF3KMT2AGMNN
SCHEMBL22434642 0.89 STING1 (1.00) STING1LMNARAPGEF3KMT2AGMNN
Cyclic Adenosine Monophosphate SCHEMBL23829673 0.89 STING1 (1.00) STING1LMNARAPGEF3KMT2AGMNN

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-9624249-B2 Nucleoside kinase bypass compositions and methods MERCK SHARP & DOHME CORP. (US) 2017-04-18 — — US disclosed
Send feedback