SCHEMBL743230

SCHEMBL743230

COC(=O)c1ccc(OC(=O)c2cccc(C)c2O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.61
ALDH1A1 P00352 4/20 0.61
MEN1 O00255 3/20 0.53
ACR P10323 3/20 0.50
L3MBTL1 Q9Y468 3/20 0.50
HGFAC Q04756 1/20 0.50
KDM4E B2RXH2 3/20 0.49
MAPT P10636 3/20 0.49
PRSS1 P07477 1/20 0.49
POLB P06746 1/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
TDP1 Q9NUW8 2/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
CA12 O43570 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46

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
SCHEMBL14690428 0.83 HSD17B10 (0.61) KMT2AALDH1A1MEN1L3MBTL1KDM4E
SCHEMBL29444214 0.83 HSD17B10 (0.61) KMT2AALDH1A1MEN1L3MBTL1KDM4E
SCHEMBL9480620 0.82 KMT2A (0.79) KMT2AALDH1A1MEN1ACRL3MBTL1
SCHEMBL334485 0.82 ALDH1A1 (0.62) KMT2AALDH1A1L3MBTL1KDM4EMAPT
SCHEMBL7615915 0.80 KMT2A (0.70) KMT2AALDH1A1MEN1ACRL3MBTL1
Methylparaben SCHEMBL30620973 0.79 ALDH1A1 (0.65) KMT2AALDH1A1MEN1L3MBTL1KDM4E
SCHEMBL4747761 0.78 CA1 (0.56) KMT2AALDH1A1MEN1ACRL3MBTL1
SCHEMBL2420797 0.78 SLC6A3 (0.60) KMT2AALDH1A1MEN1ACRL3MBTL1
SCHEMBL7518320 0.77 CA1 (0.72) KMT2AALDH1A1MEN1ACRL3MBTL1
SCHEMBL1547850 0.76 KMT2A (0.68) KMT2AALDH1A1MEN1L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2429859-A2 PROCESS FOR RESURFACING PLASTIC LENS E. I. du Pont de Nemours and Company (US) 2012-03-21 EP disclosed
US-8012923-B2 Detergent composition DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2011-09-06 US disclosed
US-20090239956-A1 LAMELLAR TYPE LIQUID CRYSTAL COMPOSITION FOR COSMETIC DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2009-09-24 US disclosed