SCHEMBL8744104

SCHEMBL8744104

NC(=O)c1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.74
ADORA3 P0DMS8 1/20 0.74
ADORA2A P29274 1/20 0.74
ADORA1 P30542 1/20 0.74
ADRA1A P35348 1/20 0.74
PDE4D Q08499 1/20 0.74
PDE3A Q14432 1/20 0.74
LMNA P02545 1/20 0.59
TP53 P04637 1/20 0.59
NT5E P21589 12/20 0.58
CD99 P14209 2/20 0.58

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
SCHEMBL8744111 1.00 PDE2A (0.74) PDE2AADORA3ADORA2AADORA1ADRA1A
Clofarabine SCHEMBL5975001 0.85 PDE2A (1.00) PDE2AADORA3ADORA2AADORA1ADRA1A
Clofarabine SCHEMBL12595105 0.85 PDE2A (1.00) PDE2AADORA3ADORA2AADORA1ADRA1A
Clofarabine SCHEMBL17752021 0.85 PDE2A (1.00) PDE2AADORA3ADORA2AADORA1ADRA1A
Clofarabine SCHEMBL9040 0.85 PDE2A (1.00) PDE2AADORA3ADORA2AADORA1ADRA1A
Clofarabine SCHEMBL23620882 0.85 PDE2A (1.00) PDE2AADORA3ADORA2AADORA1ADRA1A
Clofarabine SCHEMBL12139443 0.85 PDE2A (1.00) PDE2AADORA3ADORA2AADORA1ADRA1A
Clofarabine SCHEMBL15468200 0.85 PDE2A (1.00) PDE2AADORA3ADORA2AADORA1ADRA1A
Clofarabine SCHEMBL10026375 0.85 PDE2A (1.00) PDE2AADORA3ADORA2AADORA1ADRA1A
Clofarabine SCHEMBL1467619 0.85 PDE2A (1.00) PDE2AADORA3ADORA2AADORA1ADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0473708-B1 2-HALO-9-(2-DEOXY-2-FLUORO-B-D-ARABINOFURANOSYL) ADENINE NUCLEOSIDE DERIVATIVES SOUTHERN RES INST (US) 1997-01-15 EP disclosed