SCHEMBL9711038

SCHEMBL9711038

CC(=O)n1c(=O)c(C)cn([C@H]2O[C@@H](CO)C(O)C2OBr)c1=O

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TK2 O00142 6/20 0.44
▸ CD69 Q07108 1/20 0.39
▸ TYMP P19971 1/20 0.36
▸ PYGM P11217 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
SCHEMBL3414315 0.87 ALDH1A1 (0.45) PYGM
SCHEMBL5492045 0.79 MEN1 (0.39) TK2CD69
SCHEMBL10699714 0.77 MAPT (0.43) TYMPPYGM
SCHEMBL7019709 0.76 ALDH1A1 (0.38) TYMP
SCHEMBL31685600 0.76 TK2 (0.44) TK2TYMP
SCHEMBL6514375 0.76 CD69 (0.36) TK2CD69
SCHEMBL4654370 0.76 CD69 (0.36) TK2CD69
SCHEMBL8911352 0.74 ALDH1A1 (0.44) PYGM
SCHEMBL9092454 0.74 TYMP (0.41) CD69TYMPPYGM
SCHEMBL9711033 0.74 ADORA2A (0.32) TYMP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0513067-A1 A PRATICAL SYNTHESIS OF 2'-DEOXYNUCLEOSIDES AND 2',3'-DIDEOXY-2',3'-DIDEHYDRONUCLEOSIDES THE UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1992-11-19 — — EP disclosed
WO-1991010670-A1 A PRATICAL SYNTHESIS OF 2'-DEOXYNUCLEOSIDES AND 2',3'-DIDEOXY-2',3'-DIDEHYDRONUCLEOSIDES UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1991-07-25 — — WO disclosed
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