SCHEMBL6669313

SCHEMBL6669313

C=C(C)CC[C@]1(n2cnc3c(N)ncnc32)C[C@H](O)[C@@H](COP(=O)(O)O)O1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY1 P47900 5/20 0.51
P2RY2 P41231 3/20 0.51
SRC P12931 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
DNPH1 O43598 1/20 0.51
PRKAB2 O43741 1/20 0.51
TRPM2 O94759 1/20 0.51
LDHA P00338 1/20 0.51
ADRB2 P07550 1/20 0.51
FBP1 P09467 1/20 0.51
ADORA1 P30542 1/20 0.51
PRKAG1 P54619 1/20 0.51
PRKAA2 P54646 1/20 0.51
PDE4D Q08499 1/20 0.51
KCNH2 Q12809 1/20 0.51
PRKAA1 Q13131 1/20 0.51
PDE3A Q14432 1/20 0.51
TAS1R3 Q7RTX0 1/20 0.51
TAS1R1 Q7RTX1 1/20 0.51
P2RY11 Q96G91 1/20 0.51

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
SCHEMBL1550156 0.86 ADORA3 (0.49) SMN1; SMN2ADORA1POLB
SCHEMBL1262939 0.84 P2RY1 (0.53) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL29663587 0.84 P2RY1 (0.53) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL29937508 0.81 P2RY1 (0.58) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL31448379 0.81 P2RY1 (0.58) P2RY1P2RY2SRCSMN1; SMN2DNPH1
SCHEMBL28791555 0.80 P2RX1 (0.51) P2RY1P2RY2SRCSMN1; SMN2RNASEL
SCHEMBL28794808 0.79 P2RX1 (0.53) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL1263520 0.78 P2RX1 (0.54) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL29477144 0.77 P2RX1 (0.55) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL1085862 0.77 P2RX1 (0.55) P2RY1P2RY2SRCSMN1; SMN2TRPM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1390495-A2 IMMUNOSTIMULATORY OLIGODEOXYNUCLEIC MOLECULES Intercell AG (AT) 2004-02-25 EP claimed
WO-2002095027-A2 IMMUNOSTIMULATORY OLIGODEOXYNUCLEIC MOLECULES INTERCELL AG (AT) 2002-11-28 WO claimed
CN-1309418-C Immunostimulatory oligodeoxynucleotides CISTEM BIOTECHNOLOGIES GMBH (AT) 2007-04-11 CN disclosed
EP-1450821-A1 IMMUNOSTIMULATORY OLIGODEOXYNUCLEOTIDES Intercell AG (AT) 2004-09-01 EP disclosed
CN-1434723-A Immunostimulatory oligodeoxynucleotides CISTEM BIOTECHNOLOGIES GMBH (AT) 2003-08-06 CN disclosed
WO-2003047602-A1 IMMUNOSTIMULATORY OLIGODEOXYNUCLEOTIDES INTERCELL AG (AT) 2003-06-12 WO disclosed
EP-1296713-A1 IMMUNOSTIMULATORY OLIGODEOXYNUCLEOTIDES Cistem Biotechnologies GmbH (AT) 2003-04-02 EP disclosed
WO-2001093905-A1 IMMUNOSTIMULATORY OLIGODEOXYNUCLEOTIDES INTERCELL BIOMEDIZINISCHE FORSCHUNGS- UND ENTWICKLUNGS AG (AT) 2001-12-13 WO disclosed