SCHEMBL6567885

SCHEMBL6567885

C=CC(=O)Oc1ccccc1OC(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.58
MAPT P10636 5/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
SLC6A3 Q01959 1/20 0.51
MEN1 O00255 3/20 0.51
TDP1 Q9NUW8 2/20 0.51
CYP3A4 P08684 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
HSD17B10 Q99714 3/20 0.50
ESR1 P03372 2/20 0.50
ESR2 Q92731 2/20 0.50
JAK2 O60674 1/20 0.50
USP2 O75604 1/20 0.50
GAA P10253 1/20 0.50
ALOX15 P16050 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
SERPINE1 P05121 1/20 0.47
AKT1 P31749 1/20 0.47
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47

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
SCHEMBL29413361 0.87 THRB (0.56) KMT2AMAPTSMN1; SMN2MEN1TDP1
SCHEMBL3841280 0.87 THRB (0.56) KMT2AMAPTSMN1; SMN2MEN1TDP1
SCHEMBL725404 0.84 KMT2A (0.76) KMT2AMAPTSMN1; SMN2SLC6A3MEN1
SCHEMBL4908371 0.84 KMT2A (0.61) KMT2AMAPTMEN1TDP1L3MBTL1
Bromide SCHEMBL29588519 0.82 KMT2A (0.73) KMT2AMAPTSMN1; SMN2SLC6A3MEN1
Hydrochloric Acid SCHEMBL16050041 0.82 KMT2A (0.73) KMT2AMAPTSMN1; SMN2SLC6A3MEN1
SCHEMBL14173222 0.81 THRB (0.51) KMT2AMAPTSMN1; SMN2MEN1TDP1
SCHEMBL5517406 0.81 THRB (0.51) KMT2AMAPTSMN1; SMN2SLC6A3MEN1
SCHEMBL5530470 0.81 TDP1 (0.51) KMT2AMAPTSMN1; SMN2SLC6A3MEN1
SCHEMBL27891498 0.81 SLC6A3 (0.63) KMT2AMAPTSMN1; SMN2SLC6A3MEN1

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
EP-1478403-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA, INC. (CA) 2004-11-24 EP disclosed
WO-2003063909-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA INC. (US) 2003-08-07 WO disclosed