SCHEMBL28876641

SCHEMBL28876641

[CH2]c1nc(NC(=O)C2CC2)ccc1Br

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.57
ADORA2B P29275 7/20 0.56
ADORA2A P29274 5/20 0.56
ADORA1 P30542 4/20 0.56
ADORA3 P0DMS8 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48
ABL1 P00519 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
RXFP1 Q9HBX9 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
DEGS1 O15121 1/20 0.42
CDK2 P24941 1/20 0.41
GSK3A P49840 1/20 0.41

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
SCHEMBL23089187 0.81 HPGD (0.57) HPGDADORA2BADORA2AADORA1ADORA3
SCHEMBL1684582 0.81 HPGD (0.57) HPGDADORA2BADORA2AADORA1ADORA3
SCHEMBL30173006 0.79 HPGD (0.56) HPGDADORA2BADORA2AADORA1ADORA3
SCHEMBL24992536 0.79 HPGD (0.56) HPGDADORA2BADORA2AADORA1ADORA3
SCHEMBL23089701 0.78 HPGD (0.54) HPGDADORA2BADORA2AADORA1ADORA3
SCHEMBL23089463 0.76 HPGD (0.51) HPGDADORA2BADORA2AADORA1ADORA3
SCHEMBL23089372 0.75 ADORA2B (0.50) HPGDADORA2BADORA2AADORA1ADORA3
SCHEMBL19439102 0.74 HPGD (0.57) HPGDADORA2BADORA2AADORA1ADORA3
SCHEMBL19439103 0.73 HPGD (0.77) HPGDADORA2BADORA2AADORA1ADORA3
SCHEMBL23089545 0.72 ADORA2B (0.47) HPGDADORA2BADORA2AADORA1ADORA3

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-114945366-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2022-08-26 CN disclosed