SCHEMBL28003705

SCHEMBL28003705

Cc1ccc2c(c1)Nc1c(Cl)cccc1S2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOX1 Q9Y5S8 10/20 0.45
▸ BCHE P06276 3/20 0.45
▸ ACHE P22303 2/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ MAPT P10636 6/20 0.37
▸ GAA P10253 4/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ ALOX15 P16050 2/20 0.37
▸ SNCA P37840 2/20 0.37
▸ CYBB P04839 2/20 0.37
▸ NOX3 Q9HBY0 2/20 0.37
▸ NOX4 Q9NPH5 2/20 0.37
▸ APP P05067 1/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL28003383 0.88 MAPT (0.44) NOX1BCHEACHESMN1; SMN2POLB
SCHEMBL560873 0.80 NOX1 (0.59) NOX1BCHEACHESMN1; SMN2POLB
SCHEMBL29384027 0.80 NOX1 (0.59) NOX1BCHEACHESMN1; SMN2POLB
Hydrochloric Acid SCHEMBL28327041 0.78 NOX1 (0.57) NOX1BCHEACHESMN1; SMN2POLB
SCHEMBL12003759 0.78 NOX1 (0.57) NOX1BCHEACHESMN1; SMN2POLB
Water SCHEMBL3136465 0.78 NOX1 (0.57) NOX1BCHEACHESMN1; SMN2POLB
SCHEMBL12273297 0.77 BCHE (0.41) NOX1BCHEACHEPOLBMAPT
SCHEMBL225814 0.77 NOX1 (0.47) NOX1BCHEACHESMN1; SMN2POLB
SCHEMBL225829 0.76 NOX1 (0.65) NOX1BCHEACHESMN1; SMN2POLB
SCHEMBL20424966 0.72 SNCA (0.46) NOX1BCHEACHESMN1; SMN2POLB

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-104529938-B A kind of method synthesizing phenothiazine compound 中山大学 2016-06-08 — — CN disclosed
CN-104529938-A Novel method for synthesizing phenothiazine compounds UNIV SUN YAT SEN 2015-04-22 — — CN disclosed
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