SCHEMBL29870665

SCHEMBL29870665

CO[C@@H]1[C@H](O)[C@@H](O)O[C@H]1n1cnc2c(N(C)C(=O)c3ccccc3)ncnc21

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.51
▸ ADORA2A P29274 2/20 0.48
▸ ADORA2B P29275 2/20 0.48
▸ ADORA3 P0DMS8 3/20 0.48
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ NPEPPS P55786 6/20 0.44
▸ ANPEP P15144 6/20 0.42
▸ CYP1A2 P05177 1/20 0.42

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
SCHEMBL23579255 1.00 LMNA (0.51) LMNAADORA2AADORA2BADORA3MEN1
SCHEMBL30173466 0.83 TYMP (0.43) LMNAADORA2AADORA2BADORA3NPEPPS
SCHEMBL23579310 0.83 TYMP (0.43) LMNAADORA2AADORA2BADORA3NPEPPS
SCHEMBL29871247 0.82 ADORA2A (0.54) LMNAADORA2AADORA2BADORA3MEN1
SCHEMBL30827093 0.82 LMNA (0.42) LMNAADORA2AADORA2BADORA3NPEPPS
SCHEMBL29870413 0.82 LMNA (0.42) LMNAADORA2AADORA2BADORA3NPEPPS
SCHEMBL29792936 0.81 TYMP (0.57) LMNANPEPPSANPEP
SCHEMBL29870677 0.81 LMNA (0.60) LMNAADORA2AADORA2BNPEPPSANPEP
SCHEMBL31160186 0.80 LMNA (0.66) LMNAADORA2AADORA2BNPEPPSANPEP
SCHEMBL26554333 0.76 LMNA (0.59) LMNAADORA2AADORA2BNPEPPSANPEP

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
CN-117769598-A Polynucleotide and pharmaceutical composition 协和麒麟株式会社 2024-03-26 — — CN disclosed
CN-115176000-A Polynucleotide and pharmaceutical composition 国立大学法人东海国立大学机构 2022-10-11 — — CN disclosed
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