SCHEMBL9517673

SCHEMBL9517673

CC(=O)OCC(C)(C)CNc1ccc(Br)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
POLB P06746 2/20 0.45
RXFP1 Q9HBX9 2/20 0.45
NSD2 O96028 1/20 0.45
BLM P54132 1/20 0.45
TOP2B Q02880 1/20 0.39
MAPT P10636 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HTT P42858 1/20 0.38
PABPC1 P11940 1/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MTOR P42345 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.38
TERT O14746 7/20 0.36
MAOA P21397 1/20 0.35
PGAM1 P18669 1/20 0.35
MAPK1 P28482 2/20 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
SCHEMBL6827493 0.93 MEN1 (0.33) MEN1KMT2APOLBRXFP1NSD2
SCHEMBL7503133 0.83 MAOA (0.46) MEN1KMT2APOLBNSD2BLM
SCHEMBL9517779 0.83 MEN1 (0.48) MEN1KMT2APOLBRXFP1NSD2
SCHEMBL7962661 0.75 TOP2B (0.54) MEN1KMT2APOLBRXFP1NSD2
SCHEMBL8405348 0.74 MEN1 (0.44) MEN1KMT2APOLBRXFP1NSD2
SCHEMBL9163040 0.73 MEN1 (0.53) MEN1KMT2APOLBRXFP1NSD2
SCHEMBL8604260 0.72 MAOA (0.65) MEN1KMT2APOLBRXFP1NSD2
SCHEMBL7494612 0.72 CYP19A1 (0.43) MEN1KMT2APOLBRXFP1NSD2
SCHEMBL9358199 0.72 MEN1 (0.54) MEN1KMT2APOLBRXFP1NSD2
SCHEMBL8657009 0.71 POLB (0.50) MEN1KMT2APOLBRXFP1NSD2

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
EP-0415859-B1 Polyesters colored with the residue of heat stable anthraquinone compounds EASTMAN KODAK CO (US) 1993-11-03 EP disclosed
EP-0489841-A1 POLYESTERS COLORED WITH THE RESIDUE OF HEAT STABLE ANTHRAQUINONE COMPOUNDS EASTMAN KODAK COMPANY (US) 1992-06-17 EP disclosed
WO-1991003509-A1 POLYESTERS COLORED WITH THE RESIDUE OF HEAT STABLE ANTHRAQUINONE COMPOUNDS EASTMAN KODAK COMPANY (US) 1991-03-21 WO disclosed
US-4999418-A Food Containers EASTMAN KODAK COMPANY (US) 1991-03-12 US disclosed
EP-0415859-A1 Polyesters colored with the residue of heat stable anthraquinone compounds EASTMAN CHEMICAL COMPANY (US) 1991-03-06 EP disclosed