SCHEMBL17612661

SCHEMBL17612661

Cc1c(N)ncnc1N[C@@H]1O[C@H](CN=[N+]=[N-])[C@@H](O)[C@H]1O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 1/20 0.49
▸ ADK P55263 7/20 0.47
▸ LMNA P02545 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ HBB P68871 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ NADK O95544 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
SCHEMBL17612673 0.82 ADK (0.65) ADKSMN1; SMN2
SCHEMBL17612669 0.82 ADK (0.65) ADKSMN1; SMN2
SCHEMBL17612652 0.82 ADK (0.65) ADKSMN1; SMN2
SCHEMBL17612666 0.82 ADK (0.53) ADK
SCHEMBL17612674 0.81 ADK (0.52) AHCYADKNADK
SCHEMBL17612662 0.77 FBP1 (0.50) ADKSMN1; SMN2
SCHEMBL17612653 0.76 ADK (0.44) ADKSMN1; SMN2
SCHEMBL17612655 0.74 ADK (0.53) ADKSMN1; SMN2
SCHEMBL17612654 0.74 ADK (0.53) ADKSMN1; SMN2
SCHEMBL17612665 0.74 P2RX3 (0.49) SMN1; SMN2

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-9289398-B2 Methods for the production of functional protein from DNA having a nonsense mutation and the treatment of disorders associated therewith PTC THERAPEUTICS, INC. (US) 2016-03-22 — — US disclosed
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