SCHEMBL9813103

SCHEMBL9813103

CCOC1=CC2=C(Sc3ccccc3N2)C(Cl)C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 7/20 0.39
▸ HSD17B10 Q99714 4/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ TSHR P16473 2/20 0.36
▸ MAPT P10636 9/20 0.35
▸ MEN1 O00255 7/20 0.35
▸ KMT2A Q03164 7/20 0.35
▸ LMNA P02545 3/20 0.35
▸ NOX1 Q9Y5S8 4/20 0.35
▸ TDP1 Q9NUW8 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ ALOX15 P16050 2/20 0.35
▸ BCHE P06276 2/20 0.35
▸ ACHE P22303 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL10571684 0.86 MAPT (0.45) GAAHSD17B10MAPK1KDM4ETSHR
SCHEMBL10590992 0.80 MAPT (0.44) GAAHSD17B10MAPK1MAPTMEN1
SCHEMBL10593347 0.79 L3MBTL1 (0.43) GAAHSD17B10MAPK1KDM4ECASP1
SCHEMBL10569969 0.72 SNCA (0.50) GAAMAPK1KDM4EMAPTMEN1
SCHEMBL10575740 0.72 MEN1 (0.45) GAAHSD17B10MAPK1KDM4ETSHR
SCHEMBL10590538 0.71 MEN1 (0.40) GAAHSD17B10MAPK1KDM4ECASP1
SCHEMBL9813109 0.69 MAPT (0.44) GAAHSD17B10MAPK1KDM4ETSHR
SCHEMBL10593192 0.66 L3MBTL1 (0.43) GAAHSD17B10MAPK1KDM4ECASP1
SCHEMBL10591953 0.66 EPHX2 (0.41) GAAHSD17B10MAPK1KDM4ETSHR
SCHEMBL10591790 0.62 NOX1 (0.44) GAAMAPK1MAPTNOX1BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0138481-B1 LEUKOTRIENE BIOSYNTHESIS INHIBITORS MERCK FROSST CANADA INC. (CA) 1991-06-26 — — EP disclosed
US-4845083-A PHENOTHIAZINE DERIVATIVES AND ANALOGS MERCK FROSST CANADA, INC. (CA) 1989-07-04 — — US disclosed
EP-0115394-B1 PHENOTHIAZONE DERIVATIVES AND ANALOGS MERCK FROSST CANADA INC. (CA) 1989-06-28 — — EP disclosed
EP-0155623-A2 Use of lipoxygenase inhibitors for the preparations of cytoprotective pharmaceutical compostions and process for the preparation of a cytoprotective pharmaceutical composition MERCK & CO. INC. (US) 1985-09-25 — — EP disclosed
EP-0138481-A2 Leukotriene biosynthesis inhibitors MERCK FROSST CANADA INC. (CA) 1985-04-24 — — EP disclosed
EP-0115394-A2 Phenothiazone derivatives and analogs MERCK FROSST CANADA INC. (CA) 1984-08-08 — — EP disclosed
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