SCHEMBL7168267

SCHEMBL7168267

COC(=O)C(c1ccc(Cl)cc1)C(OC)OC

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
FFAR2 O15552 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.47
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
BRD4 O60885 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
MEN1 O00255 1/20 0.41
CNR2 P34972 1/20 0.40

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
SCHEMBL2423106 0.84 FFAR2 (0.64) KMT2AFFAR2L3MBTL1MEN1
SCHEMBL17915487 0.81 KMT2A (0.78) KMT2ASLC6A3MEN1
SCHEMBL1154849 0.78 L3MBTL1 (0.49) KMT2AFFAR2L3MBTL1SLC6A2SLC6A4
SCHEMBL4064082 0.77 ALDH1A1 (0.56) KMT2AFFAR2L3MBTL1SLC6A2SLC6A4
SCHEMBL18547195 0.77 HDAC4 (0.57) KMT2AFFAR2L3MBTL1SLC6A2SLC6A4
SCHEMBL1978245 0.77 HDAC4 (0.57) KMT2AFFAR2L3MBTL1SLC6A2SLC6A4
SCHEMBL22491773 0.77 FFAR2 (0.47) KMT2AFFAR2L3MBTL1SLC6A2SLC6A4
SCHEMBL1155156 0.76 L3MBTL1 (0.50) KMT2AFFAR2L3MBTL1SLC6A2SLC6A4
SCHEMBL21787636 0.76 L3MBTL1 (0.50) KMT2AFFAR2L3MBTL1SLC6A2SLC6A4
SCHEMBL4507146 0.76 L3MBTL1 (0.50) KMT2AFFAR2L3MBTL1SLC6A2SLC6A4

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
US-6566547-B1 3-alkoxy-2-phenylacrylic acid derivatives ZENECA LIMITED (GB) 2003-05-20 US disclosed
US-5315025-A Acrylate ethers IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1994-05-24 US disclosed
EP-0178826-B1 FUNGICIDES ZENECA LIMITED (GB) 1991-12-18 EP disclosed
EP-0431328-A2 Fungicides ZENECA LIMITED (GB) 1991-06-12 EP disclosed
EP-0178826-A2 Fungicides ZENECA LIMITED (GB) 1986-04-23 EP disclosed