SCHEMBL4593500

SCHEMBL4593500

CCCCCNc1nc(=O)n([C@H]2CC[C@@H](CO)O2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41
ALB P02768 2/20 0.39
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
PLA2G1B P04054 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
SLC29A1 Q99808 1/20 0.34

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
SCHEMBL4288554 0.82 ABL1 (0.47) LMNAABL1RIN1ALBALDH1A1
SCHEMBL4288550 0.82 ABL1 (0.47) LMNAABL1RIN1ALBALDH1A1
SCHEMBL4288553 0.82 ABL1 (0.47) LMNAABL1RIN1ALBALDH1A1
SCHEMBL11899645 0.82 ABL1 (0.46) LMNAABL1RIN1ALBALDH1A1
SCHEMBL30721652 0.81 LMNA (0.49) LMNAPLA2G1BATG4B
SCHEMBL8520282 0.78 SLC29A1 (0.56) LMNAALDH1A1PLA2G1BATG4BSLC29A1
SCHEMBL8520281 0.78 SLC29A1 (0.56) LMNAALDH1A1PLA2G1BATG4BSLC29A1
SCHEMBL4586534 0.76 ABL1 (0.52) LMNAABL1RIN1ALBALDH1A1
SCHEMBL10211477 0.76 ABL1 (0.53) LMNAABL1RIN1ALBALDH1A1
SCHEMBL10211487 0.76 ABL1 (0.46) LMNAABL1RIN1ALBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1569652-A4 N SP 4 /SP-ACYLCYTOSINE NUCLEOSIDES FOR TREATMENT OF VIRAL IINFECTIONS PHARMASSET INC (US) 2008-07-02 EP disclosed
EP-1569652-A2 N SP 4 /SP-ACYLCYTOSINE NUCLEOSIDES FOR TREATMENT OF VIRAL IINFECTIONS Pharmasset Ltd. (BB) 2005-09-07 EP disclosed
WO-2003063771-A3 N4-ACYLCYTOSINE NUCLEOSIDES FOR TREATMENT OF VIRAL IINFECTIONS PHARMASSET LTD (BB) 2005-07-07 WO disclosed
WO-2003063771-A2 N4-ACYLCYTOSINE NUCLEOSIDES FOR TREATMENT OF VIRAL IINFECTIONS PHARMASSET LTD. (BB) 2003-08-07 WO disclosed