SCHEMBL7243145

SCHEMBL7243145

COC[C@H]1O[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@@H]1OP(=O)(O)O

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TK1 P04183 6/20 0.62
POLB P06746 2/20 0.57
RNASE1 P07998 1/20 0.53
POLA1 P09884 1/20 0.53
POLD1 P28340 1/20 0.53
ALB P02768 1/20 0.53
PKM P14618 1/20 0.53
LMNA P02545 1/20 0.53
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53

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
SCHEMBL18119004 0.93 TK1 (0.59) TK1POLBRNASE1POLA1POLD1
SCHEMBL288740 0.92 TK1 (0.74) TK1POLBPOLA1POLD1
SCHEMBL21068055 0.92 TK1 (0.74) TK1POLBPOLA1POLD1
SCHEMBL7038209 0.92 TK1 (0.74) TK1POLBPOLA1POLD1
SCHEMBL2384264 0.90 POLB (0.62) TK1POLBRNASE1POLA1POLD1
SCHEMBL14713599 0.89 TK1 (0.60) TK1POLBRNASE1POLA1POLD1
SCHEMBL19884474 0.89 TK1 (0.61) TK1POLBRNASE1ALBPKM
SCHEMBL22855496 0.89 TK1 (0.61) TK1POLBRNASE1ALBPKM
SCHEMBL2230026 0.89 TK1 (0.67) TK1RNASE1ALBPKMLMNA
SCHEMBL8428685 0.89 TK1 (0.67) TK1RNASE1ALBPKMLMNA

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
US-6531476-B1 Block multiplication of virus within body and restore immune functions by virtue of inhibitory activity toward platelet activating factor UNIVERSITE PARIS 7 - DENIS DIDEROT (FR) 2003-03-11 US disclosed
EP-1095029-B1 PIPERAZINE DERIVATIVES INHIBITING HUMAN IMMUNODEFICIENCY VIRUS REPLICATION UNIV PARIS 7 DENIS DIDEROT (FR) 2002-09-18 EP disclosed
EP-1095029-A1 PIPERAZINE DERIVATIVES INHIBITING HUMAN IMMUNODEFICIENCY VIRUS REPLICATION UNIVERSITE PARIS 7 - Denis DIDEROT (FR) 2001-05-02 EP disclosed
WO-2000001677-A1 PIPERAZINE DERIVATIVES INHIBITING HUMAN IMMUNODEFICIENCY VIRUS REPLICATION UNIVERSITE PARIS 7 - DENIS DIDEROT (FR) 2000-01-13 WO disclosed