SCHEMBL6673899

SCHEMBL6673899

CCCCn1cnc(O)c2ncnc1-2

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.44
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 4/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.37
TYR P14679 1/20 0.36
TLR8 Q9NR97 2/20 0.36
AMPD2 Q01433 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
AMPD1 P23109 1/20 0.34

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
SCHEMBL6673669 0.97 ADORA2A (0.41) ADORA2ALMNACYP1A2TSHRALDH1A1
SCHEMBL6673868 0.95 ALDH1A1 (0.42) ADORA2ALMNACYP1A2TSHRALDH1A1
SCHEMBL6676177 0.90 ADORA2A (0.41) ADORA2ALMNACYP1A2TSHRALDH1A1
SCHEMBL6673124 0.83 ADORA2A (0.39) ADORA2AALDH1A1SMN1; SMN2
SCHEMBL6672679 0.81 LMNA (0.46) ADORA2ALMNACYP1A2TSHRALDH1A1
SCHEMBL6679182 0.79 RAB9A (0.37) ADORA2ALMNATSHRALDH1A1KMT2A
SCHEMBL6675408 0.79 LMNA (0.42) ADORA2ALMNACYP1A2TSHRALDH1A1
SCHEMBL6672660 0.78 LMNA (0.41) ADORA2ALMNACYP1A2TSHRALDH1A1
SCHEMBL1388038 0.77 ADORA2A (0.41) ADORA2ALMNACYP1A2TSHRALDH1A1
Hydrochloric Acid SCHEMBL7326920 0.76 ADORA2A (0.40) ADORA2ALMNACYP1A2TSHRALDH1A1

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-1202628-B1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO CELTIQUE SA (LU) 2004-10-13 EP claimed
EP-1202628-A4 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO CELTIQUE SA (LU) 2002-10-30 EP claimed
EP-1202628-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS Euro-Celtique S.A. (LU) 2002-05-08 EP claimed
WO-2001011967-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2001-02-22 WO claimed
EP-1202628-B1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO CELTIQUE SA (LU) 2004-10-13 EP disclosed
EP-1202628-A4 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO CELTIQUE SA (LU) 2002-10-30 EP disclosed
EP-1202628-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS Euro-Celtique S.A. (LU) 2002-05-08 EP disclosed
WO-2001011967-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2001-02-22 WO disclosed