SCHEMBL8366489

SCHEMBL8366489

O=c1c(/C=C/Br)cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)n1C1O[C@H](CO)[C@@H](O)[C@@H]1O

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TK2 O00142 5/20 0.65
▸ PYGM P11217 3/20 0.46
▸ TYMP P19971 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ CDA P32320 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ TK1 P04183 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ PMP22 Q01453 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ SLC28A1 O00337 1/20 0.43
▸ SLC28A2 O43868 1/20 0.43
▸ SLC29A1 Q99808 1/20 0.43
▸ SLC28A3 Q9HAS3 1/20 0.43

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
SCHEMBL8366490 1.00 TK2 (0.65) TK2PYGMTYMPMAPTCDA
SCHEMBL8333791 0.80 TK2 (0.60) TK2PYGMMAPTCDACYP1A2
SCHEMBL27773751 0.80 TK2 (0.60) TK2PYGMMAPTCDACYP1A2
SCHEMBL6753689 0.80 TK2 (0.60) TK2PYGMMAPTCDACYP1A2
SCHEMBL11665141 0.79 MAPT (0.48) PYGMTYMPMAPTCDABLM
Sorivudine SCHEMBL5511785 0.79 TK2 (1.00) TK2PYGMCYP1A2CYP3A4TSHR
Sorivudine SCHEMBL2584824 0.79 TK2 (1.00) TK2PYGMCYP1A2CYP3A4TSHR
Sorivudine SCHEMBL1981704 0.79 TK2 (1.00) TK2PYGMCYP1A2CYP3A4TSHR
Sorivudine SCHEMBL3503357 0.79 TK2 (1.00) TK2PYGMCYP1A2CYP3A4TSHR
Sorivudine SCHEMBL1981707 0.79 TK2 (1.00) TK2PYGMCYP1A2CYP3A4TSHR

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-0891374-A4 UNIQUE ASSOCIATED KAPOSI'S SARCOMA VIRUS SEQUENCES AND USES THEREOF UNIV COLUMBIA (US) 1999-04-07 — — EP disclosed
EP-0891374-A1 UNIQUE ASSOCIATED KAPOSI'S SARCOMA VIRUS SEQUENCES AND USES THEREOF The Trustees of Columbia University in the City of New York (US) 1999-01-20 — — EP disclosed
WO-1997027208-A1 UNIQUE ASSOCIATED KAPOSI'S SARCOMA VIRUS SEQUENCES AND USES THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1997-07-31 — — WO disclosed
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