SCHEMBL31330320

SCHEMBL31330320

C#CCCCn1nc[nH]c1=O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.32
ADORA2B P29275 2/20 0.32
GPR84 Q9NQS5 1/20 0.31

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
SCHEMBL2826206 0.74 ADORA2B (0.44) ADORA3ADORA2B
SCHEMBL31330327 0.71 ADORA2A (0.33) ADORA3ADORA2BGPR84
SCHEMBL31330275 0.68 ADORA2A (0.31) ADORA2B
SCHEMBL31330376 0.68 PIM1 (0.33)
SCHEMBL31330349 0.68 GSK3A (0.50) ADORA3ADORA2B
SCHEMBL31330324 0.66 ADORA2A (0.33) ADORA2B
SCHEMBL31330241 0.64 ADORA2A (0.33) ADORA2BGPR84
SCHEMBL31330313 0.64 ADORA2A (0.33) ADORA2BGPR84
SCHEMBL797328 0.62 MGLL (0.62)
SCHEMBL22925630 0.58 KDM4E (0.38)

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-2024249959-A1 COMPOSITIONS REDUCING THE EXPRESSION OR ACTIVITY OF C1 GALT1 FOR TREATING EWING SARCOMA UNIVERSITY OF MASSACHUSETTS MEDICAL SCHOOL (US) 2024-12-05 WO disclosed