SCHEMBL4872876

SCHEMBL4872876

C=CC(=O)OC(Br)(Br)C(Br)(Br)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.46
TGM2 P21980 2/20 0.38
AKT1 P31749 1/20 0.37
MAOB P27338 1/20 0.36
ALDH1A1 P00352 4/20 0.35
TSHR P16473 1/20 0.35
TEAD1 P28347 1/20 0.34
TEAD3 Q99594 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
HTT P42858 3/20 0.33
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ALOX15 P16050 2/20 0.32
CYP3A4 P08684 2/20 0.32
EGFR P00533 1/20 0.32

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
SCHEMBL5850749 0.83 THRB (0.46) THRBTGM2AKT1MAOBALDH1A1
SCHEMBL10795074 0.80 LIG1 (0.38) THRBAKT1ALDH1A1MEN1KMT2A
SCHEMBL28450603 0.79 THRB (0.46) THRBTGM2AKT1MAOBALDH1A1
SCHEMBL9273225 0.78 THRB (0.43) THRBTGM2ALDH1A1TSHRTEAD1
SCHEMBL6927418 0.78 THRB (0.45) THRBTGM2AKT1MAOBALDH1A1
SCHEMBL28562182 0.78 THRB (0.45) THRBTGM2AKT1MAOBALDH1A1
SCHEMBL30881614 0.77 THRB (0.44) THRBTGM2AKT1MAOBALDH1A1
SCHEMBL3006726 0.76 THRB (0.43) THRBTGM2AKT1ALDH1A1TSHR
SCHEMBL10479978 0.75 THRB (0.56) THRBTGM2AKT1MAOBALDH1A1
SCHEMBL351499 0.75 THRB (0.45) THRBTGM2AKT1MAOBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080015280-A1 Photosensitive Composition for Forming Optical Waveguide and Optical Waveguide JSR CORPORATION (JP) 2008-01-17 US disclosed