SCHEMBL7009665

SCHEMBL7009665

O=c1c2cc3ccc(OCc4ccccc4)cc3n2ccn1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.47
MCHR1 Q99705 9/20 0.46
KCNH2 Q12809 5/20 0.46
MAOB P27338 4/20 0.44
NPC1 O15118 3/20 0.44
MAOA P21397 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
GRM5 P41594 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA7 P43166 1/20 0.44
MTNR1A P48039 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
RAB9A P51151 2/20 0.44

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
SCHEMBL7002364 0.92 NPC1 (0.47) MCHR1KCNH2NPC1MEN1KMT2A
SCHEMBL7005823 0.85 ALOX5 (0.41) ALOX5MAOBNPC1MAOAMEN1
SCHEMBL7006729 0.84 ALOX5 (0.48) ALOX5MAOBNPC1MAOAMEN1
SCHEMBL7006801 0.83 MAPK14 (0.54) ALOX5MAOBNPC1MAOAMEN1
SCHEMBL7004499 0.81 MCHR1 (0.47) ALOX5MCHR1MAOBNPC1MAOA
SCHEMBL7004088 0.80 ALDH1A1 (0.55) MEN1KMT2A
SCHEMBL7008773 0.79 AS3MT (0.41) ALOX5MAOBNPC1MAOAMEN1
SCHEMBL7008033 0.79 AS3MT (0.41) ALOX5MAOBMAOA
SCHEMBL7003213 0.78 NSD2 (0.50) ALOX5MAOBNPC1MAOAMEN1
SCHEMBL7001976 0.78 MCHR1 (0.47) ALOX5MCHR1KCNH2MAOBNPC1

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