SCHEMBL9780986

SCHEMBL9780986

CCc1cn([C@@H]2CC[C@H](CO)O2)c(=O)[nH]c1=O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.53
TK2 O00142 1/20 0.53
LMNA P02545 4/20 0.46
ALB P02768 3/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPK1 P28482 1/20 0.46
TSHR P16473 2/20 0.45
BLM P54132 2/20 0.45
PKM P14618 1/20 0.45
PMP22 Q01453 1/20 0.45
CYP2D6 P10635 1/20 0.45
POLB P06746 1/20 0.43
ADRA1A P35348 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
SCHEMBL2035886 1.00 TK1 (0.53) TK1TK2LMNAALBALDH1A1
SCHEMBL10378935 0.91 TK1 (0.65) TK1TK2LMNAALBALDH1A1
SCHEMBL10523542 0.91 TK1 (0.65) TK1TK2LMNAALBALDH1A1
SCHEMBL13497225 0.91 TK1 (0.48) TK1TK2LMNAALBALDH1A1
SCHEMBL13366956 0.88 TK1 (0.46) TK1TK2LMNAALBALDH1A1
SCHEMBL9780924 0.87 TK1 (0.45) TK1TK2
SCHEMBL9780930 0.87 TK1 (0.45) TK1TK2
SCHEMBL14596607 0.86 LMNA (0.58) TK1LMNAALBALDH1A1TSHR
SCHEMBL762579 0.86 LMNA (0.58) TK1LMNAALBALDH1A1TSHR
SCHEMBL22992337 0.86 LMNA (0.58) TK1LMNAALBALDH1A1TSHR

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-4968788-A DRUG DELIVERY, ANTITUMOR AGENTS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1990-11-06 US claimed
US-5010060-A Method of treating herpes simplex viral infection employing pyrimidine derivatives HOFFMANN-LA ROCHE INC. (US) 1991-04-23 US disclosed
WO-1990003978-A1 5-HALOGENO-3'-FLUORO-2',3'-DIDEOXYURIDINE COMPOUNDS AND THEIR THERAPEUTIC APPLICATION STICHTING REGA VZW (BE) 1990-04-19 WO disclosed
US-4866036-A ENHANCE RESISTANCE TO OPPORTUNISTIC INFECTIONS IN COMBINATION WITH AIDS VIRICIDE MERCK & CO., INC. (US) 1989-09-12 US disclosed
US-4851519-A AMIDO NUCLEOSIDES, VIRICIDES HOFFMANN-LA ROCHE INC. (US) 1989-07-25 US disclosed
US-4841039-A 2',3'-dideoxy-5-substituted uridines and related compounds as antiviral agents EMORY UNIVERSITY (US) 1989-06-20 US disclosed
EP-0316592-A2 3'-Fluoro-2',3'-dideoxyuridine, and its therapeutic application Stichting REGA V.Z.W. (BE) 1989-05-24 EP disclosed
US-4681933-A 2',3'-dideoxy-5-substituted uridines and related compounds as antiviral agents UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1987-07-21 US disclosed