SCHEMBL7003158

SCHEMBL7003158

O=c1c2cc3ccc(OCc4ccccc4)cc3n2ccn1Cc1ccncc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.48
KDM4C Q9H3R0 2/20 0.42
ALOX5 P09917 1/20 0.41
CYP3A4 P08684 1/20 0.41
HTR6 P50406 1/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
ROCK1 Q13464 1/20 0.40
DYRK1A Q13627 1/20 0.40
CHEK1 O14757 1/20 0.40

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
SCHEMBL7006801 0.94 MAPK14 (0.54) MAPK14ALOX5
SCHEMBL7006817 0.90 SNRNP200 (0.45) MAPK14KDM4CALOX5CYP3A4
SCHEMBL7006120 0.87 CYP3A4 (0.43) MAPK14ALOX5CYP3A4CYP19A1CYP11B1
SCHEMBL7005838 0.84 TDP1 (0.42) MAPK14ALOX5
SCHEMBL7004499 0.83 MCHR1 (0.47) MAPK14ALOX5
SCHEMBL7001976 0.79 MCHR1 (0.47) MAPK14ALOX5HTR6
SCHEMBL7006729 0.79 ALOX5 (0.48) MAPK14ALOX5
SCHEMBL7009665 0.78 ALOX5 (0.47) ALOX5
SCHEMBL9194734 0.78 ROCK1 (0.54) MAPK14KDM4CALOX5CYP3A4HTR6
SCHEMBL7005488 0.75 HPGD (0.47) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200439-B1 1,2-DIHYDRO-1-OXO-PARAZINO(1,2-A) INDOLE DERIVATIVES NOVUSPHARMA SPA (IT) 2003-06-25 EP disclosed