SCHEMBL21486293

SCHEMBL21486293

CCc1c(CO)ncn1C

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
PDE4A P27815 4/20 0.33
ADORA2A P29274 4/20 0.33
PDE4B Q07343 4/20 0.33
PDE4C Q08493 4/20 0.33
PDE4D Q08499 4/20 0.33
ADORA2B P29275 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
HSD17B10 Q99714 1/20 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
SCHEMBL12569981 0.87 ALDH1A1 (0.32) APOBEC3AAPOBEC3GPDE4AADORA2APDE4B
SCHEMBL12824833 0.85 PDE4A (0.35) APOBEC3AAPOBEC3GPDE4AADORA2APDE4B
SCHEMBL24662495 0.83 APOBEC3A (0.33) APOBEC3AAPOBEC3GPDE4AADORA2APDE4B
SCHEMBL31332946 0.76 GABRB3 (0.35) APOBEC3AAPOBEC3GPDE4AADORA2APDE4B
SCHEMBL8011007 0.74
SCHEMBL22125858 0.72
SCHEMBL859688 0.72
SCHEMBL17691218 0.70
SCHEMBL2397441 0.70
SCHEMBL31332821 0.69 ADORA2B (0.32) ADORA2B

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
WO-2019200114-A1 METHODS FOR PREPARING SUBSTITUTED DIHYDROINDENE-4-CARBOXAMIDE COMPOUNDS ARBUTUS BIOPHARMA CORPORATION (CA) 2019-10-17 WO disclosed