SCHEMBL19852575

SCHEMBL19852575

CCC(O)COc1c(C)cc(Br)cc1Br

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
MAPT P10636 3/20 0.43
THRA P10827 2/20 0.39
THRB P10828 2/20 0.39
GLA P06280 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
ATM Q13315 1/20 0.38
KMT2A Q03164 6/20 0.38
MEN1 O00255 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MCL1 Q07820 1/20 0.38
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL676691 0.90 TSHR (0.52) TSHRMAPTTHRATHRBMAPK1
SCHEMBL17689248 0.81 THRB (0.45) TSHRMAPTTHRATHRBGLA
SCHEMBL13238290 0.81 ALDH1A1 (0.54) TSHRMAPTTHRATHRBGLA
SCHEMBL677393 0.79 ALDH1A1 (0.55) TSHRMAPTTHRATHRBGLA
SCHEMBL5478851 0.79 TSHR (0.58) TSHRMAPTTHRATHRBMAPK1
SCHEMBL18771396 0.78 TSHR (0.51) TSHRMAPTTHRATHRBGLA
SCHEMBL14441425 0.78 MAPT (0.47) TSHRMAPTGLAHTTKMT2A
SCHEMBL772928 0.77 TSHR (0.61) TSHRMAPTGLAKMT2AMEN1
SCHEMBL16352072 0.75 TSHR (0.51) TSHRMAPTTHRATHRBMAPK1
SCHEMBL10485988 0.74 MAPT (0.42) TSHRMAPTGLAMAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3494157-B1 STABILIZERS FOR BROMINATED POLYMERIC FLAME RETARDANTS BROMINE COMPOUNDS LTD (IL) 2021-03-03 EP disclosed
WO-2018025266-A1 STABILIZERS FOR BROMINATED POLYMERIC FLAME RETARDANTS BROMINE COMPOUNDS LTD. (IL) 2018-02-08 WO disclosed