SCHEMBL28640004

SCHEMBL28640004

CN1c2ccc(Br)cc2Sc2ccc(Cl)cc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ADRA2A P08913 2/20 0.43
ADRA2B P18089 2/20 0.43
ADRA2C P18825 2/20 0.43
CHRM3 P20309 2/20 0.43
SLC6A2 P23975 2/20 0.43
HTR2C P28335 2/20 0.43
SLC6A4 P31645 2/20 0.43
DRD3 P35462 2/20 0.43
HTR2B P41595 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
CYP1A2 P05177 3/20 0.42
CYP2D6 P10635 3/20 0.42
CYP2C19 P33261 3/20 0.42
MAOA P21397 1/20 0.42
ITGB2 P05107 1/20 0.42
ICAM1 P05362 1/20 0.42
ITGAL P20701 1/20 0.42

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
SCHEMBL12626152 0.89 NOX1 (0.49) NOX1MEN1KMT2AADRA2AADRA2B
SCHEMBL2495874 0.85 NOX1 (0.52) NOX1MEN1KMT2AADRA2AADRA2B
Bromide SCHEMBL2586940 0.83 NOX1 (0.51) NOX1MEN1KMT2AADRA2AADRA2B
SCHEMBL628328 0.80 MAOA (0.68) NOX1MEN1KMT2AADRA2AADRA2B
SCHEMBL4708655 0.80 ITGB2 (0.46) NOX1MEN1KMT2AADRA2AADRA2B
SCHEMBL4705856 0.80 NOX1 (0.47) NOX1MEN1KMT2AADRA2AADRA2B
SCHEMBL9395281 0.77 MAOA (0.68) NOX1MEN1KMT2AADRA2AADRA2B
SCHEMBL628020 0.77 MAOA (0.68) NOX1MEN1KMT2AADRA2AADRA2B
SCHEMBL4710452 0.77 NOX1 (0.44) NOX1MEN1KMT2AADRA2AADRA2B
SCHEMBL4708265 0.77 MAOA (0.42) NOX1MEN1KMT2AADRA2AADRA2B

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-113512033-B Phenoxazine and phenothiazine covalent triazine framework material, and preparation method and application thereof 南京工业大学 2023-06-16 CN disclosed
CN-113512033-A Phenoxazine and phenothiazine covalent triazine framework material and preparation method and application thereof 南京工业大学 2021-10-19 CN disclosed