SCHEMBL8569752

SCHEMBL8569752

COc1ccc(C2C(=O)c3ccc(OCc4ccccc4)cc3C2=O)c2[nH]c(CCc3ccccc3)nc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ MAOB P27338 2/20 0.40
▸ MAOA P21397 1/20 0.40
▸ PDE4A P27815 2/20 0.39
▸ PDE4B Q07343 2/20 0.39
▸ PDE4C Q08493 2/20 0.39
▸ PDE4D Q08499 2/20 0.39
▸ TOP1 P11387 1/20 0.38
▸ FFAR1 O14842 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ PRMT5 O14744 1/20 0.37
▸ STK10 O94804 1/20 0.37
▸ SLK Q9H2G2 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ NOD2 Q9HC29 1/20 0.36
▸ NOS3 P29474 1/20 0.36
▸ NOS1 P29475 1/20 0.36

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
SCHEMBL8576284 0.92 MAPT (0.41) MAPTMAPK1MAOBMAOAPDE4A
SCHEMBL8671822 0.92 MAPT (0.41) MAPTMAPK1MAOBMAOAPDE4A
SCHEMBL8601582 0.92 MAPT (0.41) MAPTMAPK1MAOBMAOAPDE4A
SCHEMBL8571260 0.91 MAPT (0.40) MAPTMAPK1MAOBMAOATOP1
SCHEMBL8598873 0.90 ADORA3 (0.40) MAPTMAPK1MAOBMAOANPSR1
SCHEMBL2528009 0.89 PDE9A (0.42) MAPTMAPK1MAOBMAOATOP1
SCHEMBL8603781 0.88 MAPT (0.42) MAPTMAPK1MAOBMAOAPDE4A
SCHEMBL8600361 0.88 PDE4A (0.38) MAPTMAPK1MAOBMAOAPDE4A
SCHEMBL8572042 0.87 PRMT5 (0.48) MAPTMAPK1MAOBMAOATOP1
SCHEMBL8571345 0.87 MAPT (0.41) MAPTMAPK1MAOBMAOAPDE4A

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
WO-1998005327-A1 SUBSTITUTED AROMATIC COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-02-12 — — WO disclosed
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