SCHEMBL28397996

SCHEMBL28397996

c1ccc(-c2c[nH]c(Cc3cccnc3)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.56
CYP11B2 P19099 4/20 0.56
HRH4 Q9H3N8 2/20 0.49
HRH3 Q9Y5N1 2/20 0.49
GSK3B P49841 1/20 0.44
GPR84 Q9NQS5 2/20 0.42
P2RX7 Q99572 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP19A1 P11511 2/20 0.41
HPGDS O60760 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40

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
SCHEMBL2843756 0.91 CYP11B1 (0.61) CYP11B1CYP11B2HRH4HRH3GSK3B
SCHEMBL2314813 0.90 HPGDS (0.52) CYP11B1CYP11B2HRH4HRH3ALDH1A1
SCHEMBL3856407 0.86 NR1H2 (0.50) HRH3GSK3BRAB9ANPC1GAA
SCHEMBL28400754 0.83 HRH4 (0.44) CYP11B1CYP11B2HRH4HRH3P2RX7
SCHEMBL28890163 0.83 GSK3B (0.54) CYP11B1CYP11B2HRH4HRH3GSK3B
SCHEMBL28889070 0.82 P2RX7 (0.49) HRH4HRH3P2RX7KDM4EALDH1A1
SCHEMBL10133074 0.80 NR1H2 (0.44) CYP11B1CYP11B2GSK3BRAB9ANPC1
SCHEMBL2838285 0.79 HPGDS (0.48) CYP11B1CYP11B2HRH4HRH3GSK3B
SCHEMBL28406033 0.79 HRH4 (0.46) CYP11B1CYP11B2HRH4HRH3P2RX7
SCHEMBL2838089 0.78 CYP11B1 (0.46) CYP11B1CYP11B2GSK3BHPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111057043-A Imidazole compound, preparation method and application thereof, organic weldable protective agent containing imidazole compound and surface treatment method 深圳市贝加电子材料有限公司 2020-04-24 CN claimed
CN-111057043-B Imidazole compound, preparation method and application thereof, organic weldable protective agent containing imidazole compound and surface treatment method 深圳市贝加电子材料有限公司 2021-11-02 CN disclosed
CN-111057043-A Imidazole compound, preparation method and application thereof, organic weldable protective agent containing imidazole compound and surface treatment method 深圳市贝加电子材料有限公司 2020-04-24 CN disclosed