SCHEMBL8906384

SCHEMBL8906384

COc1ccc(C(OC[C@H]2O[C@@H](n3ccc(NC(=O)c4ccc(C)cc4)nc3=O)C[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
ABL1 P00519 1/20 0.46
RIN1 Q13671 1/20 0.46
TYMP P19971 2/20 0.45
NT5E P21589 2/20 0.43
P2RY6 Q15077 2/20 0.42
P2RY14 Q15391 2/20 0.42
ADORA3 P0DMS8 1/20 0.40
TYMS P04818 1/20 0.38
DUT P33316 2/20 0.36
F2 P00734 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL10491019 0.97 POLB (0.54) POLBABL1RIN1TYMPNT5E
SCHEMBL5925303 0.95 POLB (0.56) POLBABL1RIN1TYMPNT5E
SCHEMBL5358852 0.95 POLB (0.56) POLBABL1RIN1TYMPNT5E
SCHEMBL1527090 0.94 POLB (0.57) POLBABL1RIN1TYMPNT5E
SCHEMBL11134759 0.91 POLB (0.53) POLBABL1RIN1TYMPNT5E
SCHEMBL2368809 0.91 POLB (0.53) POLBABL1RIN1TYMPNT5E
SCHEMBL24115327 0.91 TYMP (0.48) POLBABL1RIN1TYMPNT5E
SCHEMBL31556049 0.91 TYMP (0.48) POLBABL1RIN1TYMPNT5E
SCHEMBL20596260 0.91 TYMP (0.48) POLBABL1RIN1TYMPNT5E
SCHEMBL31556085 0.91 TYMP (0.48) POLBABL1RIN1TYMPNT5E

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
US-5695979-A USING OLIGONUCLEOTIDE COMPETITIVE TECHNOLOGIES, INC. (US) 1997-12-09 US disclosed
US-5453496-A Viricides UNIVERSITY PATENTS, INC. (US) 1995-09-26 US disclosed
US-5278302-A Monophosphates UNIVERSITY PATENTS, INC. (US) 1994-01-11 US disclosed
EP-0378615-A4 NUCLEOSIDE AND POLYNUCLEOTIDE THIOPHOSPHORAMIDITE AND PHOSPHORODITHIOATE COMPOUNDS AND PROCESSES 1992-04-08 EP disclosed
EP-0463712-A2 Polynucleotide phosphorodithioates as therapeutic agents for retroviral infections UNIVERSITY PATENTS, INC. (US) 1992-01-02 EP disclosed
WO-1990012022-A1 POLYNUCLEOTIDE PHOSPHORODITHIOATES AS THERAPEUTIC AGENTS FOR RETROVIRAL INFECTIONS UNIVERSITY PATENTS, INC. (US) 1990-10-18 WO disclosed
EP-0378615-A1 NUCLEOSIDE AND POLYNUCLEOTIDE THIOPHOSPHORAMIDITE AND PHOSPHORODITHIOATE COMPOUNDS AND PROCESSES COMPETITIVE TECHNOLOGIES INC. (US) 1990-07-25 EP disclosed
WO-1989011486-A1 NUCLEOSIDE AND POLYNUCLEOTIDE THIOPHOSPHORAMIDITE AND PHOSPHORODITHIOATE COMPOUNDS AND PROCESSES UNIVERSITY PATENTS, INC. (US) 1989-11-30 WO disclosed