SCHEMBL28638540

SCHEMBL28638540

Clc1ccc(-c2cnc(-c3cnccn3)[nH]2)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 12/20 1.00
SCN2A Q99250 2/20 0.44
JAK2 O60674 1/20 0.43
HRH1 P35367 1/20 0.43
NOTUM Q6P988 1/20 0.43
HPGDS O60760 2/20 0.42
ADORA2A P29274 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
SCHEMBL6960490 0.80 NPY5R (0.65) NPY5RADORA2A
SCHEMBL28629827 0.77 NPY5R (0.63) NPY5RNOTUMADORA2A
SCHEMBL29712850 0.77 NPY5R (0.63) NPY5RNOTUMADORA2A
SCHEMBL31660150 0.70 NPY5R (0.65) NPY5RSCN2AHRH1HPGDS
SCHEMBL26094809 0.70 NPY5R (0.65) NPY5RSCN2AHRH1HPGDS
SCHEMBL14365142 0.68 NPY5R (0.51) NPY5RSCN2AHPGDS
SCHEMBL7811963 0.68 NPY5R (0.61) NPY5RSCN2AHRH1
SCHEMBL7815763 0.68 NPY5R (0.61) NPY5RSCN2AHRH1
SCHEMBL7812141 0.68 NPY5R (0.61) NPY5RSCN2AHRH1
Hydrochloric Acid SCHEMBL7815919 0.67 NPY5R (0.60) NPY5RSCN2AHRH1

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