SCHEMBL8378478

SCHEMBL8378478

COC(=O)c1cc(Br)c(C(=O)OC)c(C(=O)c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
HPGD P15428 4/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2D6 P10635 2/20 0.49
CYP2C19 P33261 2/20 0.49
HTT P42858 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KDM4E B2RXH2 2/20 0.42
LMNA P02545 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 2/20 0.42
SLC6A3 Q01959 2/20 0.42
PGR P06401 1/20 0.42
SLC6A2 P23975 1/20 0.42
PDE4A P27815 1/20 0.42
MAPK1 P28482 1/20 0.42
HRH1 P35367 1/20 0.42
PDE4D Q08499 1/20 0.42

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
SCHEMBL8380474 0.82 TSHR (0.51) TSHRHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL8546447 0.79 HPGD (0.46) TSHRHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL5561626 0.79 CA1 (0.54) TSHRL3MBTL1KDM4ELMNAALDH1A1
SCHEMBL8674887 0.78 TSHR (0.53) TSHRHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL8941202 0.77 KDM4E (0.40) TSHRHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL8381827 0.76 KDM4E (0.54) TSHRHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL8378602 0.76 TSHR (0.50) TSHRHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL8441864 0.76 TSHR (0.69) TSHRHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL8443482 0.75 TSHR (0.58) TSHRHPGDCYP1A2CYP2D6CYP2C19
SCHEMBL5965482 0.75 AKR1C3 (0.51) TSHRHPGDCYP1A2CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0713502-B1 NAPHTHALENEDICARBOXYLIC ACID CONTAINING POLYMER/HALOGEN COMPOUND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEM CO (US) 1999-04-07 EP claimed
EP-0713502-A1 NAPHTHALENEDICARBOXYLIC ACID CONTAINING POLYMER/HALOGEN COMPOUND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1996-05-29 EP claimed
US-5418318-A Packaging EASTMAN CHEMICAL COMPANY (US) 1995-05-23 US claimed
WO-1995004769-A1 NAPHTHALENEDICARBOXYLIC ACID CONTAINING POLYMER/HALOGEN COMPOUND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1995-02-16 WO claimed
US-5919403-A POLYESTERS EASTMAN CHEMICAL COMPANY (US) 1999-07-06 US disclosed
EP-0713502-B1 NAPHTHALENEDICARBOXYLIC ACID CONTAINING POLYMER/HALOGEN COMPOUND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEM CO (US) 1999-04-07 EP disclosed
CN-1209146-A Polymeric fluorescence quenching compounds and their use EASTMAN CHEM CO (US) 1999-02-24 CN disclosed
CN-1209150-A Polyester blend compositions containing naphthalene dicarboxylate having reduced fluorescence EASTMAN CHEM CO (US) 1999-02-24 CN disclosed
EP-0868488-A1 NAPHTHALENEDICARBOXYLATE CONTAINING POLYESTER BLEND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1998-10-07 EP disclosed
US-5705600-A MELT BLENDING A POLYESTER AND POLYAMIDE WITH FLUORESCENCE QUENCHING COMPOUND EASTMAN CHEMICAL COMPANY (US) 1998-01-06 US disclosed
WO-1997023568-A1 NAPHTHALENEDICARBOXYLATE CONTAINING POLYESTER BLEND COMPOSITIONS HAVING REDUCED FLUORESCENCE EASTMAN CHEMICAL COMPANY (US) 1997-07-03 WO disclosed
US-5418318-A Packaging EASTMAN CHEMICAL COMPANY (US) 1995-05-23 US disclosed
US-5391701-A Containing difunctional aromatic monomer having at least one halogen group directly attached to ring EASTMAN CHEMICAL COMPANY (US) 1995-02-21 US disclosed