SCHEMBL10500412

SCHEMBL10500412

COCOc1cc2c(c3ccccc13)Nc1ccccc1S2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOX1 Q9Y5S8 11/20 0.43
▸ GAA P10253 7/20 0.43
▸ MAPT P10636 7/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ TDP1 Q9NUW8 3/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ ALOX15 P16050 4/20 0.41
▸ BCHE P06276 2/20 0.41
▸ ACHE P22303 2/20 0.41
▸ SNCA P37840 2/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.41
▸ ALOX12 P18054 1/20 0.41

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
SCHEMBL10501198 0.85 NOX1 (0.51) NOX1GAAMAPTMEN1KMT2A
SCHEMBL10500416 0.76 NOX1 (0.47) NOX1GAAMAPTMEN1KMT2A
SCHEMBL10500800 0.74 NOX1 (0.38) NOX1GAAMAPTMEN1KMT2A
SCHEMBL20444659 0.74 NOX1 (0.52) NOX1GAAMAPTMEN1KMT2A
SCHEMBL10558875 0.73 ELANE (0.43) NOX1GAAMAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL10501359 0.73 NOX1 (0.38) NOX1GAAMAPTMEN1KMT2A
SCHEMBL10500786 0.72 MAPT (0.44) NOX1GAAMAPTMEN1KMT2A
SCHEMBL10505587 0.71 NOX1 (0.52) NOX1GAAMAPTMEN1KMT2A
Phenothiazine SCHEMBL28704963 0.67 NOX1 (0.81) NOX1GAAMAPTMEN1KMT2A
SCHEMBL30622722 0.67 NOX1 (0.50) NOX1GAAMAPTMEN1KMT2A

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
US-4876246-A Benzo[a]phenothiazines and hydro-derivatives for inhibiting leukotriene biosynthesis MERCK FROSST CANADA, INC. (CA) 1989-10-24 — — US disclosed
EP-0136893-B1 Benzo[a]phenothiazines and hydro-derivatives and pharmaceutical compositions containing them MERCK FROSST CANADA INC. (CA) 1989-08-16 — — EP disclosed
US-4611056-A Benzo[A]phenothiazines and hydro-derivatives MERCK FROSST CANADA, INC. (CA) 1986-09-09 — — US disclosed
EP-0136893-A2 Benzo[a]phenothiazines and hydro-derivatives and pharmaceutical compositions containing them MERCK FROSST CANADA INC. (CA) 1985-04-10 — — EP disclosed
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