SCHEMBL9759808

SCHEMBL9759808

Nc1ncnc2c1ncn2[C@H]1C[C@@H](CO)[C@H]1CO

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AHCY P23526 14/20 0.75
ADORA2B P29275 2/20 0.75
ADORA3 P0DMS8 1/20 0.56
ADORA2A P29274 1/20 0.56
ADORA1 P30542 1/20 0.56
SLC28A1 O00337 1/20 0.56
SLC28A2 O43868 1/20 0.56

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
SCHEMBL6691588 1.00 AHCY (0.75) AHCYADORA2BADORA3ADORA2AADORA1
SCHEMBL8537239 1.00 AHCY (0.75) AHCYADORA2BADORA3ADORA2AADORA1
SCHEMBL9470389 1.00 AHCY (0.75) AHCYADORA2BADORA3ADORA2AADORA1
SCHEMBL8537515 1.00 AHCY (0.75) AHCYADORA2BADORA3ADORA2AADORA1
SCHEMBL1980695 1.00 AHCY (0.75) AHCYADORA2BADORA3ADORA2AADORA1
SCHEMBL15630293 1.00 AHCY (0.75) AHCYADORA2BADORA3ADORA2AADORA1
SCHEMBL2449534 1.00 AHCY (0.75) AHCYADORA2BADORA3ADORA2AADORA1
SCHEMBL10448266 1.00 AHCY (0.75) AHCYADORA2BADORA3ADORA2AADORA1
SCHEMBL15630223 1.00 AHCY (0.75) AHCYADORA2BADORA3ADORA2AADORA1
SCHEMBL8537235 1.00 AHCY (0.75) AHCYADORA2BADORA3ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3095165-A None JP disclosed
JP-H0395165-A NEW CYCLOBUTANE DERIVATIVE AND ITS PRODUCTION NIPPON KAYAKU CO LTD 1991-04-19 JP disclosed
EP-0358154-A2 Novel cyclobutane derivative and process for producing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1990-03-14 EP disclosed