SCHEMBL11195576

SCHEMBL11195576

N[C@H]1[C@@H](O)[C@@H](n2cnc3c(NC(=O)c4ccccc4)ncnc32)O[C@@H]1C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 1/20 0.60
▸ ADORA1 P30542 1/20 0.60
▸ ADORA2A P29274 8/20 0.58
▸ ADORA2B P29275 8/20 0.58
▸ AHCY P23526 2/20 0.53
▸ HIF1A Q16665 1/20 0.53
▸ TMEM97 Q5BJF2 1/20 0.53
▸ SIGMAR1 Q99720 1/20 0.53

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
SCHEMBL10884710 1.00 ADORA3 (0.60) ADORA3ADORA1ADORA2AADORA2BAHCY
SCHEMBL10889457 0.91 ADORA3 (0.58) ADORA3ADORA1ADORA2AADORA2BAHCY
SCHEMBL11215188 0.88 ADORA2A (0.57) ADORA3ADORA2AADORA2B
SCHEMBL10888025 0.88 ADORA2A (0.57) ADORA3ADORA2AADORA2B
SCHEMBL19146527 0.87 ADORA3 (0.62) ADORA3ADORA1ADORA2AADORA2B
SCHEMBL13964749 0.86 ADORA2A (0.58) ADORA3ADORA2AADORA2BAHCYHIF1A
SCHEMBL19190143 0.86 ADORA2A (0.58) ADORA3ADORA2AADORA2BAHCYHIF1A
SCHEMBL13974841 0.86 ADORA2A (0.58) ADORA3ADORA2AADORA2BAHCYHIF1A
SCHEMBL13964740 0.86 ADORA2A (0.58) ADORA3ADORA2AADORA2BAHCYHIF1A
SCHEMBL23169438 0.83 LMNA (0.57) —

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
EP-0071926-A1 New ribofuranuronic acid derivatives, processes for preparation thereof and pharmaceutical compositions thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-02-16 — — EP disclosed
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