SCHEMBL28923906

SCHEMBL28923906

Clc1cccc(-n2ccnc2-c2cnccn2)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 12/20 0.43
NPC1 O15118 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RAB9A P51151 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TNKS2 Q9H2K2 1/20 0.39
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37
HCAR1 Q9BXC0 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL28636867 0.79 P2RX7 (0.39) P2RX7NPC1SMN1; SMN2RAB9AHSD17B10
SCHEMBL28634259 0.78 P2RX7 (0.41) P2RX7NPC1SMN1; SMN2RAB9AHSD17B10
SCHEMBL8041789 0.71 HCAR1 (0.42) P2RX7DRD2DRD3HCAR1
SCHEMBL984877 0.71 HCAR1 (0.34) P2RX7DRD2DRD3HCAR1
SCHEMBL28170355 0.71 P2RX7 (0.51) P2RX7KDM4E
SCHEMBL4408345 0.70 FYN (0.47) P2RX7DRD2DRD3
SCHEMBL13073299 0.66 IDO1 (0.46) HCAR1
SCHEMBL29604515 0.65 PIEZO1 (0.40) P2RX7NPC1SMN1; SMN2RAB9AHSD17B10
SCHEMBL3948877 0.63 IDO1 (0.48) P2RX7NPC1SMN1; SMN2RAB9AHSD17B10
SCHEMBL11126232 0.63 CYP1A2 (0.40) P2RX7NPC1SMN1; SMN2RAB9AHSD17B10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113234062-B Pyrazinylimidazole compound, weldable protective agent, preparation method and application of pyrazinylimidazole compound and weldable protective agent 赣州市贝加尔电子材料有限公司 2022-07-08 CN disclosed
CN-113234062-A Pyrazinylimidazole compound, weldable protective agent, preparation method and application of pyrazinylimidazole compound and weldable protective agent 赣州市贝加尔电子材料有限公司 2021-08-10 CN disclosed