SCHEMBL6675408

SCHEMBL6675408

CCCCCn1cnc(S)c2ncnc1-2

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
ADORA2A P29274 2/20 0.40
ALDH1A1 P00352 4/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP1A2 P05177 1/20 0.38
TSHR P16473 1/20 0.38
TLR8 Q9NR97 2/20 0.38
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
AMPD1 P23109 2/20 0.33
AMPD2 Q01433 1/20 0.33
KDR P35968 3/20 0.33

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
SCHEMBL6672660 0.98 LMNA (0.41) LMNAADORA2AALDH1A1TDP1CYP1A2
SCHEMBL6672679 0.95 LMNA (0.46) LMNAADORA2AALDH1A1TDP1CYP1A2
SCHEMBL6673669 0.83 ADORA2A (0.41) LMNAADORA2AALDH1A1TDP1CYP1A2
SCHEMBL6673868 0.81 ALDH1A1 (0.42) LMNAADORA2AALDH1A1TDP1CYP1A2
SCHEMBL6673899 0.79 ADORA2A (0.44) LMNAADORA2AALDH1A1TDP1CYP1A2
SCHEMBL1387975 0.78 ALDH1A1 (0.39) LMNAADORA2AALDH1A1TDP1CYP1A2
Hydrochloric Acid SCHEMBL7327162 0.77 ALDH1A1 (0.39) LMNAADORA2AALDH1A1TDP1CYP1A2
SCHEMBL1388168 0.77 CTSL (0.39) LMNAADORA2AALDH1A1TDP1CYP1A2
Hydrochloric Acid SCHEMBL7382272 0.76 CTSL (0.38) LMNAADORA2AALDH1A1TDP1CYP1A2
SCHEMBL6675467 0.74 SMN1; SMN2 (0.33) LMNAADORA2AALDH1A1TSHRPOLB

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