SCHEMBL8626465

SCHEMBL8626465

O=C(c1ccc(C(=O)c2ccc(F)c([N+](=O)[O-])c2)cc1)c1ccc(F)c([N+](=O)[O-])c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 7/20 0.62
VCAM1 P19320 3/20 0.61
ITGB1 P05556 1/20 0.58
ITGA5 P08648 1/20 0.58
ALDH1A1 P00352 4/20 0.56
HIF1A Q16665 2/20 0.56
GPR35 Q9HC97 2/20 0.54
ABCC3 O15438 1/20 0.54
ABCC4 O15439 1/20 0.54
NR1I2 O75469 1/20 0.54
ABCB11 O95342 1/20 0.54
NR3C1 P04150 1/20 0.54
PGR P06401 1/20 0.54
HTR1A P08908 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
RARB P10826 1/20 0.54
COMT P21964 1/20 0.54
SLC6A2 P23975 1/20 0.54
ADORA1 P30542 1/20 0.54
ADRA1A P35348 1/20 0.54

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
SCHEMBL4605109 0.98 VCAM1 (0.62) TTRVCAM1ITGB1ITGA5ALDH1A1
SCHEMBL10076773 0.95 TTR (0.70) TTRVCAM1ITGB1ITGA5ALDH1A1
SCHEMBL7497537 0.93 VCAM1 (0.68) TTRVCAM1ITGB1ITGA5ALDH1A1
SCHEMBL8625345 0.93 ALDH1A1 (0.64) TTRVCAM1ITGB1ITGA5ALDH1A1
SCHEMBL332714 0.93 VCAM1 (0.63) TTRVCAM1ITGB1ITGA5ALDH1A1
Ammonia Solution, Strong SCHEMBL27483503 0.92 VCAM1 (0.66) TTRVCAM1ITGB1ITGA5ALDH1A1
SCHEMBL8627482 0.91 ITGB1 (0.58) TTRVCAM1ITGB1ITGA5ALDH1A1
Methyl Alcohol SCHEMBL28111073 0.91 VCAM1 (0.64) TTRVCAM1ITGB1ITGA5ALDH1A1
Carbamic Acid SCHEMBL28101135 0.89 MAPK1 (0.62) TTRVCAM1ITGB1ITGA5ALDH1A1
SCHEMBL9307787 0.89 VCAM1 (0.81) TTRVCAM1ITGB1ITGA5ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0518543-B1 Polyimide and process for the preparation thereof MITSUI TOATSU CHEMICALS (JP) 1997-03-12 EP claimed
US-5710334-A PENDANT ETHER GROUPS, POLYIMIDES WITH IMPROVED SOLUBILITY, MELT FLOW STABILITY, PROCESSABILITY MITSUI TOATSU CHEMICALS, INC. (JP) 1998-01-20 US disclosed
EP-0572196-B1 Polyimide, and preparation process of same MITSUI TOATSU CHEMICALS (JP) 1997-08-06 EP disclosed
EP-0518543-B1 Polyimide and process for the preparation thereof MITSUI TOATSU CHEMICALS (JP) 1997-03-12 EP disclosed
US-5480965-A BASED ON A NOVEL DIAMINO COMPOUND DERIVED FROM BENZOPHENONE STRUCTURE; FIBER REINFORCEMENT MITSUI TOATSU CHEMICALS, INC. (JP) 1996-01-02 US disclosed
US-5354890-A Aromatic diamine intermediates useful in the preparation of polyimides MITSUI TOATSU CHEMICALS, INC. (JP) 1994-10-11 US disclosed
EP-0572196-A1 Polyimide, and preparation process of same MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-12-01 EP disclosed
US-5260388-A Reacting aromatic diamine with tetracarboxylic anhydride in presence of aromatic dicarboxylic anhydride or monoamine, imidizing; low dielectric characteristics; electronics MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1993-11-09 US disclosed
EP-0518543-A2 Polyimide and process for the preparation thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-12-16 EP disclosed