SCHEMBL9464683

SCHEMBL9464683

BrC1c2ccccc2C(Br)C(Br)C1Br

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
GAA P10253 1/20 0.32
KDM1A O60341 5/20 0.31
HTR2A P28223 2/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
GPR3 P46089 1/20 0.31

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
SCHEMBL8678894 0.86 MEN1 (0.35) MEN1KMT2AGAAKDM1AHTR2A
Bromide SCHEMBL28573320 0.79 KDM1A (0.33) MEN1KMT2AGAAKDM1AHTR2A
SCHEMBL11874756 0.73 CACNB4 (0.32) ALDH1A1
SCHEMBL12238736 0.73 GPR3 (0.32) GPR3
SCHEMBL31124667 0.72 MEN1 (0.35) MEN1KMT2AGAAKDM1AHTR2A
SCHEMBL19373822 0.71
SCHEMBL3263053 0.71 GPR3 (0.46) MEN1KMT2AHTR2AGPR3
SCHEMBL28348254 0.69 MEN1 (0.33) MEN1KMT2AHTR2AGPR3
SCHEMBL12657209 0.68
SCHEMBL12215518 0.65 HTR2A (0.58) HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5225573-A Oxidizing in the liquid phase BROMINE COMPOUNDS LIMITED (IL) 1993-07-06 US disclosed
US-5015685-A Preparation of tetrabromotetralin BROMINE COMPOUNDS LTD. (IL) 1991-05-14 US disclosed
US-5015685-A Preparation of tetrabromotetralin BROMINE COMPOUNDS LTD. (IL) 1991-05-14 US disclosed
US-5015685-A Preparation of tetrabromotetralin BROMINE COMPOUNDS LTD. (IL) 1991-05-14 US disclosed