SCHEMBL11575822

SCHEMBL11575822

C=CCc1c(Br)cc(Br)c(CC=C)c1-c1c(CC=C)c(Br)cc(Br)c1CC=C

nearest known ligand 0.31

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.31
IMPDH2 P12268 1/20 0.31
POLB P06746 1/20 0.31
GABRA1 P14867 2/20 0.30
GABRB2 P47870 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ALDH2 P05091 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
AKR1B1 P15121 1/20 0.30
HPGD P15428 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30
PPARG P37231 1/20 0.30
KMT2A Q03164 1/20 0.30
PPARD Q03181 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL11832723 0.82
SCHEMBL6317714 0.74 CA2 (0.32) POLB
SCHEMBL7671774 0.73 IMPDH2 (0.37) IMPDH2
SCHEMBL10400366 0.72 CYP3A4 (0.39) XDHPOLBGABRA1GABRB2KDM4E
SCHEMBL8623552 0.72 ALOX15 (0.47) POLBALDH1A1HPGD
SCHEMBL9485968 0.69 GABRA1 (0.41) XDHPOLBGABRA1GABRB2KDM4E
SCHEMBL5831274 0.67 ALDH1A1 (0.33) XDHIMPDH2POLBGABRA1GABRB2
SCHEMBL3437109 0.67
SCHEMBL1624906 0.66 TDP1 (0.48) POLBALDH1A1MAPTAKR1B1PPARG
SCHEMBL7077104 0.65 XDH (0.40) XDHPOLBGABRA1GABRB2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4170711-A FLAME RETARDANTS FOR POLYESTERS, POLYCARBONATES, AND POLYURETHANES GENERAL ELECTRIC COMPANY (US) 1979-10-09 US disclosed
US-4170711-A FLAME RETARDANTS FOR POLYESTERS, POLYCARBONATES, AND POLYURETHANES GENERAL ELECTRIC COMPANY (US) 1979-10-09 US disclosed
US-3989531-A POLYSTYRENE GENERAL ELECTRIC COMPANY (US) 1976-11-02 US disclosed
US-3989531-A POLYSTYRENE GENERAL ELECTRIC COMPANY (US) 1976-11-02 US disclosed
US-3956403-A Brominated biphenols GENERAL ELECTRIC COMPANY (US) 1976-05-11 US disclosed