SCHEMBL9507482

SCHEMBL9507482

O=P(Oc1ccccc1)(Oc1cccc(Br)c1Br)Oc1cccc(Br)c1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.44
SRC P12931 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HTT P42858 2/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA5B Q9Y2D0 1/20 0.34
NPC1 O15118 1/20 0.33

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
SCHEMBL30503411 0.89 INPPL1 (0.38) HPGDCYP3A4TSHRLMNAMEN1
SCHEMBL161085 0.89 INPPL1 (0.38) HPGDCYP3A4TSHRLMNAMEN1
SCHEMBL30503410 0.89 INPPL1 (0.38) HPGDCYP3A4TSHRLMNAMEN1
SCHEMBL29167176 0.87 HPGD (0.47) HPGDSRCL3MBTL1TDP1CYP3A4
SCHEMBL9505666 0.86 SRC (0.41) HPGDSRCL3MBTL1TDP1CYP3A4
SCHEMBL9014853 0.86 SRC (0.41) HPGDSRCL3MBTL1TDP1CYP3A4
SCHEMBL343722 0.81 SRC (0.54) HPGDSRCL3MBTL1TDP1CYP3A4
SCHEMBL9622392 0.78 SRC (0.47) SRCL3MBTL1TDP1CYP3A4TSHR
SCHEMBL2472741 0.77 HTR7 (0.38) HPGDSRCKDM4ELMNAMEN1
SCHEMBL29735537 0.77 HTR7 (0.38) HPGDSRCKDM4ELMNAMEN1

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
EP-0244393-B1 FLAME RETARDANT POLYPHENYLENE ETHER MOLDING COMPOSITIONS FMC Corporation (US) 1993-06-23 EP disclosed
US-4710530-A CONTAINING POLYBROMOTRIPHENYL PHOSPHATES FMC CORPORATION (US) 1987-12-01 US disclosed
EP-0244393-A2 Flame retardant polyphenylene ether molding compositions FMC Corporation (US) 1987-11-04 EP disclosed