SCHEMBL8904604

SCHEMBL8904604

Nc1ccc(Oc2ccc(-c3ccc(Oc4ccc(N)cc4)c(Cl)c3)cc2Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 2/20 0.59
MAOA P21397 2/20 0.50
MAOB P27338 1/20 0.50
ALDH1A1 P00352 6/20 0.48
CYP3A4 P08684 2/20 0.48
TSHR P16473 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.46
MEN1 O00255 3/20 0.46
MAPT P10636 3/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
CYP2C19 P33261 1/20 0.46
NCOA1 Q15788 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
MITF O75030 1/20 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
SCHEMBL4318630 0.88 PDE7A (0.63) PDE7AMAOAMAOBALDH1A1CYP3A4
SCHEMBL554810 0.85 MAOA (0.61) PDE7AMAOAMAOBALDH1A1CYP3A4
SCHEMBL31457272 0.84 NCOA1 (0.50) PDE7AMAOAMAOBALDH1A1CYP3A4
SCHEMBL22069710 0.82 PDE7A (0.54) PDE7AMAOAMAOBALDH1A1CYP3A4
SCHEMBL9440384 0.81 MAPT (0.57) PDE7AMAOAMAOBALDH1A1CYP3A4
SCHEMBL21186209 0.81 PDE7A (0.56) PDE7AMAOAMAOBALDH1A1CYP3A4
SCHEMBL10701923 0.81 PDE7A (0.56) PDE7AMAOAMAOBALDH1A1CYP3A4
SCHEMBL31264488 0.81 PDE7A (0.56) PDE7AMAOAMAOBALDH1A1CYP3A4
SCHEMBL22452604 0.81 PDE7A (0.52) PDE7AMAOAMAOBALDH1A1CYP3A4
SCHEMBL2509239 0.81 PDE7A (0.56) PDE7AMAOAMAOBALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650463-A Carbon fiber-reinforced polimide resin composition MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-22 US disclosed
US-5554765-A HEAT RESISTANCE MITSUI TOATSU CHEMICALS, INC. (JP) 1996-09-10 US disclosed
EP-0523240-B1 BISIMIDE COMPOUNDS, POLYIMIDE RESIN COMPOSITION PREPARED THEREFROM, AND CARBON FIBER-REINFORCED POLYIMIDE RESIN COMPOSITION MITSUI TOATSU CHEMICALS (JP) 1996-03-20 EP disclosed
US-5457154-A Melt processability MITSUI TOATSU CHEMICALS, INC. (JP) 1995-10-10 US disclosed
EP-0523240-A1 BISIMIDE COMPOUNDS, POLYIMIDE RESIN COMPOSITION PREPARED THEREFROM, AND CARBON FIBER-REINFORCED POLYIMIDE RESIN COMPOSITION MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-20 EP disclosed