SCHEMBL5795524

SCHEMBL5795524

c1ccc2c(c1)Nc1ccc(-c3ccc4c(c3)Sc3ccccc3N4)cc1S2

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX1 Q9Y5S8 10/20 0.71
MAPT P10636 7/20 0.71
GAA P10253 6/20 0.71
SNCA P37840 4/20 0.71
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
ALOX15 P16050 3/20 0.71
TDP1 Q9NUW8 2/20 0.71
BCHE P06276 2/20 0.71
ACHE P22303 2/20 0.71
CYP1A2 P05177 2/20 0.71
POLB P06746 1/20 0.71
CYP3A4 P08684 1/20 0.71
ADORA3 P0DMS8 1/20 0.71
ALOX12 P18054 1/20 0.71
MAOA P21397 1/20 0.71
CNR1 P21554 1/20 0.71
PTGS1 P23219 1/20 0.71
SLC6A2 P23975 1/20 0.71
HTR2C P28335 1/20 0.71

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
Phenothiazine SCHEMBL4173671 1.00 NOX1 (0.71) NOX1MAPTGAASNCAMEN1
SCHEMBL3974421 0.94 NOX1 (0.65) NOX1MAPTGAASNCAMEN1
SCHEMBL239282 0.94 NOX1 (0.63) NOX1MAPTGAASNCAMEN1
SCHEMBL5139470 0.88 MAPT (0.58) NOX1MAPTGAASNCAMEN1
SCHEMBL30958692 0.88 NOX1 (0.52) NOX1MAPTGAASNCAMEN1
SCHEMBL239745 0.88 NOX1 (0.52) NOX1MAPTGAASNCAMEN1
Hydrochloric Acid SCHEMBL28668248 0.86 NOX1 (0.68) NOX1MAPTGAASNCAMEN1
SCHEMBL29321272 0.85 NOX1 (0.52) NOX1MAPTGAASNCAMEN1
SCHEMBL19268829 0.85 NOX1 (0.52) NOX1MAPTGAASNCAMEN1
SCHEMBL17124545 0.85 NOX1 (0.52) NOX1MAPTGAASNCAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116041812-A Vulcanized neoprene capable of being repeatedly processed and preparation method thereof 安徽忠德输送工程技术有限公司 2023-05-02 CN disclosed
EP-3398218-A1 NEW EMITTER MATERIALS AND MATRIX MATERIALS FOR OPTOELECTRONIC AND ELECTRONIC COMPONENTS, IN PARTICULAR ORGANIC LIGHT-EMITTING DIODES (OLEDS) Technische Universität Dresden (DE) 2018-11-07 EP disclosed
WO-2017114857-A1 NEW EMITTER MATERIALS AND MATRIX MATERIALS FOR OPTOELECTRONIC AND ELECTRONIC COMPONENTS, IN PARTICULAR ORGANIC LIGHT-EMITTING DIODES (OLEDS) Technische Universität Dresden (DE) 2017-07-06 WO disclosed
WO-2006041263-A1 CHROMOPHORE COMPOUNDS AND ORGANIC ELECTROLUMINESCENC DISPLAY DEVICE COMPRISING THE SAME DOOSAN CORPORATION (KR) 2006-04-20 WO disclosed