SCHEMBL6039883

SCHEMBL6039883

COc1ncnc2c(NC3O[C@H](CO)[C@@H](O)[C@H]3O)ncnc12

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 1/20 0.50
▸ ADORA1 P30542 1/20 0.41
▸ PYGB P11216 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL9805192 1.00 ADK (0.50) ADKADORA1PYGBTSHRMEN1
SCHEMBL29466237 1.00 ADK (0.50) ADKADORA1PYGBTSHRMEN1
SCHEMBL6039895 1.00 ADK (0.50) ADKADORA1PYGBTSHRMEN1
SCHEMBL9805157 0.85 ADK (0.57) ADKADORA1TSHRMEN1KMT2A
SCHEMBL9805249 0.81 ADK (0.51) ADKADORA1TSHRMEN1KMT2A
SCHEMBL9805237 0.81 ADK (0.65) ADKADORA1MEN1KMT2A
SCHEMBL9805553 0.81 ADK (0.65) ADKADORA1MEN1KMT2A
SCHEMBL9805185 0.81 PI4KA (0.40) ADKADORA1MEN1KMT2A
SCHEMBL29062123 0.79 ADK (0.47) ADKADORA1
SCHEMBL30105884 0.79 ADK (0.47) ADKADORA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060078977-A1 Novel purified polypeptides from Enterococcus faecalis AFFINIUM PHARMACEUTICALS, INC. (CA) 2006-04-13 — — US disclosed
US-5041542-A Antitumor-anticarcinogenic agents NUCLEIC ACID RESEARCH INSTITUTE (US) 1991-08-20 — — US disclosed
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