SCHEMBL3845982

SCHEMBL3845982

Nc1nc2[nH]c(C3(CO)CCC3)nc2c(=O)n1C1(CO)CCC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8340809 0.66 JAK2 (0.34) —
SCHEMBL8667325 0.66 PNP (0.38) —
SCHEMBL3845992 0.63 RXFP1 (0.31) —
SCHEMBL8667323 0.63 PNP (0.53) —
SCHEMBL3845989 0.58 JAK2 (0.32) —
SCHEMBL3694622 0.56 — —
SCHEMBL9470564 0.54 HPRT1 (0.44) —
SCHEMBL9470349 0.54 LMNA (0.39) —
SCHEMBL8340807 0.53 PNP (0.33) —
SCHEMBL10629392 0.51 KDM4E (0.36) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8592397-B2 Compositions and methods for combination antiviral therapy GILEAD SCIENCES, INC. (US) 2013-11-26 — — US disclosed
EP-1828145-A4 2' AND 3' - SUBSTITUTED CYCLOBUTYL NUCLEOSIDE ANALOGS FOR THE TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION UNIV EMORY (US) 2009-08-19 — — EP disclosed
US-20090143314-A1 COMPOSITIONS AND METHODS FOR COMBINATION ANTIVIRAL THERAPY GILEAD SCIENCES, INC. (US) 2009-06-04 — — US disclosed
EP-1828145-A2 2' AND 3' - SUBSTITUTED CYCLOBUTYL NUCLEOSIDE ANALOGS FOR THE TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION EMORY UNIVERSITY (US) 2007-09-05 — — EP disclosed
US-20060246130-A1 Compositions and methods for combination antiviral therapy GILEAD SCIENCES, INC. 2006-11-02 — — US disclosed
WO-2006063281-A2 2' AND 3' - SUBSTITUTED CYCLOBUTYL NUCLEOSIDE ANALOGS FOR THE TREATMENT OF VIRAL INFECTIONS AND ABNORMAL CELLULAR PROLIFERATION EMORY UNIVERSITY (US) 2006-06-15 — — WO disclosed
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