SCHEMBL17189114

SCHEMBL17189114

O=P(c1ccccc1)(c1ccccc1)N1c2ccccc2Sc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 13/20 0.46
▸ MAOA P21397 1/20 0.45
▸ ACHE P22303 5/20 0.44
▸ NOX1 Q9Y5S8 2/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HTR2C P28335 2/20 0.39
▸ DRD3 P35462 2/20 0.39
▸ HTR2B P41595 2/20 0.39
▸ HTR1A P08908 1/20 0.39
▸ ADRB3 P13945 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HTR6 P50406 1/20 0.39
▸ ADRA2A P08913 1/20 0.39
▸ ADRA2B P18089 1/20 0.39
▸ ADRA2C P18825 1/20 0.39
▸ CHRM3 P20309 1/20 0.39
▸ SLC6A2 P23975 1/20 0.39
▸ SLC6A4 P31645 1/20 0.39

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
SCHEMBL17189553 0.85 BCHE (0.46) BCHEMAOAACHENOX1MEN1
SCHEMBL23331914 0.77 MAOA (0.45) BCHEMAOAACHENOX1MEN1
SCHEMBL17189020 0.73 P2RX4 (0.47) —
SCHEMBL19367113 0.72 HDAC6 (0.41) BCHEMAOAACHENOX1MEN1
SCHEMBL16167325 0.72 HDAC6 (0.55) BCHEMAOAACHENOX1MEN1
SCHEMBL21510234 0.71 NOX1 (0.38) BCHEMAOAACHENOX1MEN1
SCHEMBL15237169 0.67 NOX1 (0.53) BCHEMAOAACHENOX1LMNA
SCHEMBL1718054 0.67 MAOA (0.64) BCHEMAOAACHENOX1MEN1
SCHEMBL30300504 0.65 BCHE (0.73) BCHEACHENOX1HTR2CDRD3
SCHEMBL4446747 0.65 BCHE (0.73) BCHEACHENOX1HTR2CDRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015158689-A1 HOST MATERIALS FOR OELDS CYNORA GMBH (DE) 2015-10-22 — — WO disclosed
WO-2015158692-A1 HOST MATERIALS CYNORA GMBH (DE) 2015-10-22 — — WO disclosed
EP-2933853-A1 Host materials for OLEDs cynora GmbH (DE) 2015-10-21 — — EP disclosed
EP-2933855-A1 Host materials cynora GmbH (DE) 2015-10-21 — — EP disclosed
EP-2933849-A1 Host materials for OLEDs cynora GmbH (DE) 2015-10-21 — — EP disclosed
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