SCHEMBL730390

SCHEMBL730390

O=C(OC(=O)c1ccc(F)c(C(=O)O)c1)c1ccc(F)c(C(=O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.41
CES1 P23141 3/20 0.41
LMNA P02545 2/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
SIRT5 Q9NXA8 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
CYP3A4 P08684 1/20 0.40
KDM4E B2RXH2 3/20 0.39
HSD17B10 Q99714 2/20 0.39
ASPH Q12797 1/20 0.39
KDM8 Q8N371 1/20 0.39
CDC25A P30304 1/20 0.39
CDC25B P30305 1/20 0.39
PLA2G7 Q13093 1/20 0.38
POLB P06746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALB P02768 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
SCHEMBL2714458 0.85 ALDH1A1 (0.50) LMNAMAPK1HTTRAB9ACYP3A4
SCHEMBL336060 0.84 KDM4E (0.52) CES2CES1LMNAMAPK1HTT
SCHEMBL4358318 0.82 TDP1 (0.55) CES2CES1SIRT5CYP3A4KDM4E
SCHEMBL27350624 0.82 HSD17B10 (0.57) LMNARAB9AKDM4EHSD17B10CDC25A
SCHEMBL1401558 0.81 CA12 (0.54) LMNAMAPK1HTTRAB9ACYP3A4
SCHEMBL17478757 0.78 AKR1C3 (0.53)
SCHEMBL2581290 0.78 PARP1 (0.47) CES2CES1SIRT5CYP3A4KDM4E
SCHEMBL29436298 0.77 KDM4E (0.50) LMNAHTTRAB9AKDM4EHSD17B10
SCHEMBL14421297 0.76 POLB (0.53) CES2CES1LMNAMAPK1HTT
SCHEMBL17262460 0.76 SORT1 (0.45) CES2CES1LMNAMAPK1HTT

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 3 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-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