SCHEMBL9601706

SCHEMBL9601706

Cc1nc(N)c2ncn([C@H]3CC[C@@H](CO)O3)c2n1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
ALDH1A1 P00352 1/20 0.57
ALB P02768 1/20 0.57
MAPK1 P28482 1/20 0.57
CYP1A2 P05177 1/20 0.53
PNP P00491 1/20 0.48
TP53 P04637 1/20 0.48
HTT P42858 1/20 0.48
PDE4D Q08499 1/20 0.48
PDE3A Q14432 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
ADA P00813 1/20 0.44
ADORA2A P29274 1/20 0.43
ADORA2B P29275 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
SCHEMBL13524238 0.88 ALDH1A1 (0.56) LMNAALDH1A1ALBMAPK1CYP1A2
SCHEMBL25712959 0.88 LMNA (0.59) LMNAALDH1A1ALBMAPK1CYP1A2
SCHEMBL3239663 0.88 LMNA (0.59) LMNAALDH1A1ALBMAPK1CYP1A2
SCHEMBL7435133 0.87 LMNA (0.58) LMNAALDH1A1ALBMAPK1CYP1A2
SCHEMBL9810657 0.86 LMNA (0.55) LMNAALDH1A1ALBMAPK1CYP1A2
SCHEMBL26289484 0.86 LMNA (0.55) LMNAALDH1A1ALBMAPK1CYP1A2
SCHEMBL5548925 0.86 LMNA (0.57) LMNAALDH1A1ALBMAPK1CYP1A2
SCHEMBL2808298 0.86 LMNA (0.58) LMNAALDH1A1ALBMAPK1CYP1A2
SCHEMBL22862138 0.86 LMNA (0.58) LMNAALDH1A1ALBMAPK1CYP1A2
SCHEMBL8124562 0.86 LMNA (0.65) LMNAALDH1A1ALBMAPK1CYP1A2

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-0355135-A4 ADENOSINE DEAMINASE-STABLE ANTI-RETROVIRAL NUCLEOSIDES. SCRIPPS CLINIC RES (US) 1990-04-09 EP claimed
EP-0355135-A1 ADENOSINE DEAMINASE-STABLE ANTI-RETROVIRAL NUCLEOSIDES SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1990-02-28 EP claimed
WO-1989004662-A1 ADENOSINE DEAMINASE-STABLE ANTI-RETROVIRAL NUCLEOSIDES SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1989-06-01 WO claimed
EP-0355135-B1 ADENOSINE DEAMINASE-STABLE ANTI-RETROVIRAL NUCLEOSIDES SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1993-08-04 EP disclosed
US-4997926-A Viricides SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1991-03-05 US disclosed
EP-0355135-A4 ADENOSINE DEAMINASE-STABLE ANTI-RETROVIRAL NUCLEOSIDES. SCRIPPS CLINIC RES (US) 1990-04-09 EP disclosed
EP-0355135-A1 ADENOSINE DEAMINASE-STABLE ANTI-RETROVIRAL NUCLEOSIDES SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1990-02-28 EP disclosed
WO-1989004662-A1 ADENOSINE DEAMINASE-STABLE ANTI-RETROVIRAL NUCLEOSIDES SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1989-06-01 WO disclosed