SCHEMBL8601582

SCHEMBL8601582

COc1ccc(C2C(=O)c3ccc(OCc4ccccc4)cc3C2=O)c2[nH]c(Cc3ccccc3)nc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ TOP1 P11387 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ PDE4A P27815 2/20 0.38
▸ PDE4B Q07343 2/20 0.38
▸ PDE4C Q08493 2/20 0.38
▸ PDE4D Q08499 2/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ PNP P00491 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PRMT5 O14744 1/20 0.38
▸ STK10 O94804 1/20 0.37
▸ SLK Q9H2G2 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL8598873 0.97 ADORA3 (0.40) MAPTMAPK1MAOAMAOBADORA3
SCHEMBL2528009 0.93 PDE9A (0.42) MAPTMAPK1MAOAMAOBTOP1
SCHEMBL8576284 0.93 MAPT (0.41) MAPTMAPK1MAOAMAOBTOP1
SCHEMBL8671822 0.93 MAPT (0.41) MAPTMAPK1MAOAMAOBTOP1
SCHEMBL8574117 0.93 TDP2 (0.39) MAPTMAPK1MAOAMAOBKDM4E
SCHEMBL8569752 0.92 MAPT (0.40) MAPTMAPK1MAOAMAOBTOP1
SCHEMBL8571260 0.92 MAPT (0.40) MAPTMAPK1MAOAMAOBTOP1
SCHEMBL8603781 0.89 MAPT (0.42) MAPTMAPK1MAOAMAOBTOP1
SCHEMBL8600361 0.88 PDE4A (0.38) MAPTMAPK1MAOAMAOBTOP1
SCHEMBL8572042 0.88 PRMT5 (0.48) MAPTMAPK1MAOAMAOBTOP1

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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