SCHEMBL17612653

SCHEMBL17612653

Cc1c(N)ncnc1N[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 7/20 0.44
▸ CA1 P00915 5/20 0.40
▸ CA2 P00918 5/20 0.40
▸ HSPA8 P11142 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL17612648 0.82 ADK (0.45) ADK
SCHEMBL17612673 0.82 ADK (0.65) ADKCA1CA2HSPA8SMN1; SMN2
SCHEMBL17612666 0.82 ADK (0.53) ADK
SCHEMBL17612652 0.82 ADK (0.65) ADKCA1CA2HSPA8SMN1; SMN2
SCHEMBL17612669 0.82 ADK (0.65) ADKCA1CA2HSPA8SMN1; SMN2
SCHEMBL17612670 0.81 ADK (0.44) ADK
SCHEMBL17612674 0.81 ADK (0.52) ADKHSPA8
SCHEMBL17612675 0.81 ADK (0.41) ADK
SCHEMBL17612647 0.81 ADK (0.44) ADK
SCHEMBL12870450 0.79 ADK (0.71) ADKCA1CA2

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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