SCHEMBL31330134

SCHEMBL31330134

CCc1cc2nc(Br)sc2[nH]c1=O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.36
GRIN3B O60391 2/20 0.36
GRIN1 Q05586 2/20 0.36
GRIN2A Q12879 2/20 0.36
GRIN2B Q13224 2/20 0.36
GRIN2C Q14957 2/20 0.36
GRIN3A Q8TCU5 2/20 0.36
HCAR2 Q8TDS4 9/20 0.34
TMIGD3 P0DMS9 1/20 0.32
ADORA1 P30542 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PDE3B Q13370 1/20 0.31
PDE3A Q14432 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
SCHEMBL31330040 0.82 SMN1; SMN2 (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31330115 0.81 GRIN2D (0.34) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31330088 0.80 HCAR2 (0.39) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31330075 0.80 RAB9A (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL26451159 0.80 HCAR2 (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL31330123 0.78 ALDH1A1 (0.43) HCAR2ALDH1A1KDM4EPDE3BPDE3A
SCHEMBL31330011 0.66 KDM4E (0.44) TMIGD3ADORA1KDM4EPDE3BPDE3A
SCHEMBL31330120 0.66 KDM4E (0.44) HCAR2TMIGD3ADORA1ALDH1A1KDM4E
SCHEMBL24649829 0.66 PARP1 (0.46) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL25093466 0.66 GRIN2D (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
CN-119371425-A Nitrogen-containing heterocyclic compound, preparation method and medical application thereof 中国医药研究开发中心有限公司 2025-01-28 CN disclosed