SCHEMBL20138905

SCHEMBL20138905

C#CCO[C@H]1[C@@H](O)[C@H](n2cnc3c(N)ncnc32)O[C@@H]1CO

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 4/20 0.68
▸ ADORA1 P30542 3/20 0.68
▸ SMN1; SMN2 Q16637 2/20 0.68
▸ DPP4 P27487 1/20 0.68
▸ MEN1 O00255 1/20 0.68
▸ SLC28A1 O00337 1/20 0.68
▸ MAP3K7 O43318 1/20 0.68
▸ SLC28A2 O43868 1/20 0.68
▸ GAPDH P04406 1/20 0.68
▸ MAPK1 P28482 1/20 0.68
▸ ADORA2A P29274 1/20 0.68
▸ ADORA2B P29275 1/20 0.68
▸ STAT6 P42226 1/20 0.68
▸ PI4KA P42356 1/20 0.68
▸ KMT2A Q03164 1/20 0.68
▸ PI4K2B Q8TCG2 1/20 0.68
▸ DOT1L Q8TEK3 1/20 0.68
▸ SLC29A1 Q99808 1/20 0.68
▸ PI4K2A Q9BTU6 1/20 0.68
▸ SLC28A3 Q9HAS3 1/20 0.68

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
SCHEMBL1061068 0.92 ADORA3 (0.68) ADORA3ADORA1SMN1; SMN2DPP4MEN1
SCHEMBL22333908 0.92 ADORA3 (0.68) ADORA3ADORA1SMN1; SMN2DPP4MEN1
SCHEMBL1061070 0.92 ADORA3 (0.68) ADORA3ADORA1SMN1; SMN2DPP4MEN1
SCHEMBL28569675 0.92 ADORA3 (0.68) ADORA3ADORA1SMN1; SMN2DPP4MEN1
SCHEMBL29498967 0.92 ADORA3 (0.68) ADORA3ADORA1SMN1; SMN2DPP4MEN1
SCHEMBL28991007 0.92 ADORA3 (0.68) ADORA3ADORA1SMN1; SMN2DPP4MEN1
SCHEMBL3437097 0.88 ADORA3 (0.71) ADORA3ADORA1SMN1; SMN2DPP4MEN1
SCHEMBL13064102 0.87 ADORA3 (0.72) ADORA3ADORA1SMN1; SMN2DPP4MEN1
SCHEMBL13777063 0.87 ADORA3 (0.72) ADORA3ADORA1SMN1; SMN2DPP4MEN1
SCHEMBL25599621 0.87 ADORA1 (0.58) ADORA3ADORA1SMN1; SMN2DPP4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112888791-A Identification and analysis of microbial samples by rapid incubation and nucleic acid enrichment 伊鲁米那股份有限公司 2021-06-01 — — CN claimed
EP-3538653-B1 TAGLESS ENCODED CHEMICAL LIBRARY NANNA THERAPEUTICS LTD (GB) 2021-07-28 — — EP disclosed
CN-112888791-A Identification and analysis of microbial samples by rapid incubation and nucleic acid enrichment 伊鲁米那股份有限公司 2021-06-01 — — CN disclosed
WO-2020223259-A1 IDENTIFICATION AND ANALYSIS OF MICROBIAL SAMPLES BY RAPID INCUBATION AND NUCLEIC ACID ENRICHMENT ILLUMINA, INC. (US) 2020-11-05 — — WO disclosed
EP-3538653-A1 TAGLESS ENCODED CHEMICAL LIBRARY Nanna Therapeutics Limited (GB) 2019-09-18 — — EP disclosed
US-20190264199-A1 TAGLESS ENCODED CHEMICAL LIBRARY Nanna Therapeutics Limited (GB) 2019-08-29 — — US disclosed
WO-2018087539-A1 TAGLESS ENCODED CHEMICAL LIBRARY BACTEVO LTD (GB) 2018-05-17 — — WO disclosed
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