SCHEMBL28330296

SCHEMBL28330296

ClCc1coc(-c2cccc3nc4cc(Br)ccc4nc23)n1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 1/20 0.36
PIK3CA P42336 1/20 0.36
DRD2 P14416 9/20 0.36
DRD4 P21917 9/20 0.36
DRD3 P35462 9/20 0.36
NQO2 P16083 4/20 0.35
PTPN11 Q06124 1/20 0.32
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30
RAB9A P51151 1/20 0.30
BLM P54132 1/20 0.30
CASP6 P55212 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL28331654 1.00 PIK3R1 (0.36) PIK3R1PIK3CADRD2DRD4DRD3
SCHEMBL28331666 0.87 ALDH1A1 (0.38) DRD2DRD4DRD3NQO2PTPN11
SCHEMBL28878889 0.87 PIK3R1 (0.37) PIK3R1PIK3CANQO2PTPN11MEN1
SCHEMBL28330293 0.87 PIK3R1 (0.37) PIK3R1PIK3CANQO2PTPN11MEN1
SCHEMBL28331686 0.86 MAPT (0.34) NQO2PTPN11MEN1ALDH1A1POLB
SCHEMBL28330294 0.86 PTPN11 (0.32) NQO2PTPN11MEN1ALDH1A1POLB
SCHEMBL28330291 0.86 NQO2 (0.44) NQO2PTPN11MEN1ALDH1A1POLB
SCHEMBL28330292 0.86 PTPN11 (0.32) NQO2PTPN11MEN1ALDH1A1POLB
SCHEMBL28331660 0.86 NQO2 (0.44) NQO2PTPN11MEN1ALDH1A1POLB
SCHEMBL28331720 0.86 MAPT (0.34) NQO2PTPN11MEN1ALDH1A1POLB

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-110551117-B Phenazine compound containing oxazole ring and application of phenazine compound as agricultural bactericide 南京农业大学 2022-09-27 CN disclosed
CN-110551117-A Phenazine compound containing oxazole ring and application of phenazine compound as agricultural bactericide UNIV NANJING AGRICULTURAL 2019-12-10 CN disclosed