SCHEMBL4585577

SCHEMBL4585577

Cc1ccc(C(=O)OC[C@H]2O[C@@H](n3ccc(N)nc3=O)[C@H](O)[C@@H]2O)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.64
THRB P10828 1/20 0.64
MTOR P42345 1/20 0.64
MDM2 Q00987 1/20 0.64
NCOA1 Q15788 1/20 0.64
NCOA3 Q9Y6Q9 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.56
TSHR P16473 1/20 0.55
GLA P06280 1/20 0.55
P2RY2 P41231 1/20 0.53
ST6GAL1 P15907 6/20 0.51
PNP P00491 1/20 0.49

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
Hydrochloric Acid SCHEMBL11858047 0.99 LMNA (0.62) LMNATHRBMTORMDM2NCOA1
SCHEMBL5985845 0.90 LMNA (0.61) LMNATHRBMTORMDM2NCOA1
SCHEMBL4665032 0.90 LMNA (0.64) LMNATHRBMTORMDM2NCOA1
SCHEMBL13678671 0.89 LMNA (0.66) LMNATHRBMTORMDM2NCOA1
SCHEMBL441997 0.89 LMNA (0.66) LMNATHRBMTORMDM2NCOA1
SCHEMBL4586059 0.89 LMNA (0.58) LMNATHRBMTORMDM2NCOA1
Hydrochloric Acid SCHEMBL11852550 0.88 LMNA (0.65) LMNATHRBMTORMDM2NCOA1
SCHEMBL338182 0.88 LMNA (0.59) LMNATHRBMTORMDM2NCOA1
SCHEMBL6060610 0.87 LMNA (0.69) LMNATHRBMTORMDM2NCOA1
SCHEMBL236108 0.87 LMNA (0.69) LMNATHRBMTORMDM2NCOA1

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
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-A2 N4-ACYLCYTOSINE NUCLEOSIDES FOR TREATMENT OF VIRAL IINFECTIONS PHARMASSET LTD. (BB) 2003-08-07 WO disclosed