SCHEMBL7170446

SCHEMBL7170446

C[C@H]1O[C@@H](n2cnc3cncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.56
DNMT3B Q9UBC3 1/20 0.51
ADK P55263 12/20 0.47

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
SCHEMBL3404192 0.82 DNMT3B (0.53) DNMT3B
Nebularine SCHEMBL29362246 0.81 ADA (0.65) ADORA3DNMT3B
Nebularine SCHEMBL27552329 0.81 ADA (0.65) ADORA3DNMT3B
Nebularine SCHEMBL1894168 0.81 ADA (0.65) ADORA3DNMT3B
Nebularine SCHEMBL10666450 0.81 ADA (0.65) ADORA3DNMT3B
Nebularine SCHEMBL745560 0.81 ADA (0.65) ADORA3DNMT3B
Nebularine SCHEMBL9644429 0.81 ADA (0.65) ADORA3DNMT3B
Nebularine SCHEMBL29799158 0.81 ADA (0.65) ADORA3DNMT3B
Nebularine SCHEMBL742475 0.81 ADA (0.65) ADORA3DNMT3B
Nebularine SCHEMBL93409 0.81 ADA (0.65) ADORA3DNMT3B

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
US-6531454-B1 Inhibiting growth of cancer cells, modulating estrogen receptor activity, treating, preventing or delaying onset of breast cancer or osteoporosis, reducing risk of cardiovascular disease THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-03-11 US disclosed
US-6420344-B1 ANTICANCER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2002-07-16 US disclosed
WO-2000055166-A1 GLYCOSYLATED POLYAMINES REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-09-21 WO disclosed