SCHEMBL5363085

SCHEMBL5363085

O=C1OC2(c3ccc(O)cc3Oc3c2cc(I)c(O)c3I)c2ccccc21

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.78
KMT2A Q03164 5/20 0.78
TDP1 Q9NUW8 4/20 0.78
RECQL P46063 3/20 0.78
BLM P54132 3/20 0.78
ACE2 Q9BYF1 2/20 0.78
USP2 O75604 2/20 0.78
THRB P10828 2/20 0.78
CDK2 P24941 1/20 0.78
CHAT P28329 1/20 0.78
BLVRB P30043 1/20 0.78
RXFP1 Q9HBX9 1/20 0.78
L3MBTL1 Q9Y468 1/20 0.78
FTO Q9C0B1 8/20 0.70
MAPT P10636 4/20 0.70
PRMT1 Q99873 2/20 0.70
HTT P42858 2/20 0.70
HPGD P15428 2/20 0.70
CYP2C19 P33261 1/20 0.70
SMAD3 P84022 1/20 0.70

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
Erythrosine SCHEMBL7646050 0.97 MEN1 (0.80) MEN1KMT2ATDP1RECQLBLM
Erythrosine SCHEMBL29356181 0.88 MEN1 (1.00) MEN1KMT2ATDP1RECQLBLM
Erythrosine SCHEMBL25042 0.88 MEN1 (1.00) MEN1KMT2ATDP1RECQLBLM
Erythrosine SCHEMBL29353687 0.88 MEN1 (1.00) MEN1KMT2ATDP1RECQLBLM
SCHEMBL9307936 0.88 MEN1 (0.80) MEN1KMT2ATDP1RECQLBLM
SCHEMBL30160703 0.88 MEN1 (0.80) MEN1KMT2ATDP1RECQLBLM
Erythrosine SCHEMBL1461335 0.87 MEN1 (0.97) MEN1KMT2ATDP1RECQLBLM
Erythrosine SCHEMBL250944 0.87 MEN1 (0.97) MEN1KMT2ATDP1RECQLBLM
Erythrosine SCHEMBL18526925 0.87 MEN1 (0.97) MEN1KMT2ATDP1RECQLBLM
Erythrosine SCHEMBL3686955 0.87 MEN1 (0.97) MEN1KMT2ATDP1RECQLBLM

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
US-7306632-B2 Leave-in color conditioner HAIRMARKER LLC (US) 2007-12-11 US disclosed
US-20050198746-A1 Leave-in color conditioner HAIRMARKER LLC 2005-09-15 US disclosed