SCHEMBL730357

SCHEMBL730357

O=C(c1ccc(O)cc1)c1cc(C(=O)c2ccc(O)cc2)cc([N+](=O)[O-])c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
MAPT P10636 2/20 0.56
HTT P42858 2/20 0.56
ESR1 P03372 1/20 0.56
ESR2 Q92731 1/20 0.56
PKM P14618 1/20 0.56
HPGD P15428 1/20 0.56
SRD5A2 P31213 3/20 0.55
GAA P10253 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MAPK1 P28482 2/20 0.50
POLB P06746 1/20 0.50
CYP3A4 P08684 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MMP2 P08253 1/20 0.47
MMP3 P08254 1/20 0.47
CES1 P23141 1/20 0.47
TTR P02766 2/20 0.46

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
SCHEMBL28435034 0.96 LMNA (0.56) LMNAMAPTHTTESR1ESR2
SCHEMBL4686670 0.86 SRD5A2 (0.71) LMNAMAPTHTTESR1ESR2
SCHEMBL9306598 0.84 CES2 (0.64) LMNAMAPTGAAALDH1A1TDP1
Dinitrophenylene SCHEMBL28053873 0.84 CES1 (0.62) LMNAMAPTHTTESR1ESR2
SCHEMBL10013242 0.83 MAPK1 (0.61) SRD5A2L3MBTL1ALDH1A1TDP1MAPK1
SCHEMBL1566658 0.82 CYP3A4 (0.68) LMNAMAPTSRD5A2GAAL3MBTL1
SCHEMBL31574444 0.82 HTT (0.83) LMNAMAPTHTTESR1ESR2
SCHEMBL6161137 0.80 MEN1 (0.62) LMNAMAPTSRD5A2GAAL3MBTL1
SCHEMBL728795 0.80 MAPK1 (0.62) LMNAMAPTHTTHPGDSRD5A2
SCHEMBL214448 0.79 CES2 (0.61) SRD5A2L3MBTL1ALDH1A1TDP1MAPK1

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-8138257-B1 Bis(trialkylsiloxyphenyl)-arylfluoride imide AB2 monomers, hyperbranched polymers and nanoclay composites therefrom THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2012-03-20 US disclosed
US-8138257-B1 Bis(trialkylsiloxyphenyl)-arylfluoride imide AB2 monomers, hyperbranched polymers and nanoclay composites therefrom THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2012-03-20 US disclosed
US-8138257-B1 Bis(trialkylsiloxyphenyl)-arylfluoride imide AB2 monomers, hyperbranched polymers and nanoclay composites therefrom THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2012-03-20 US disclosed
US-6639042-B1 Organic solvent soluble THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2003-10-28 US disclosed
US-6512124-B1 N-(3,5-bis(4-hydroxybenzoyl)benzene)-4-fluoroisophthalimide. Aromatic polyimides (Pls) are well known, high-performance materials with widespread applications in the aerospace and electronics industries due to their excellent thermomechanical THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2003-01-28 US disclosed