SCHEMBL2482437

SCHEMBL2482437

Cc1cc(CC(C)C)cc(OC(=O)c2ccccc2)c1OC(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
MEN1 O00255 2/20 0.44
CYP3A4 P08684 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.41
SLC6A3 Q01959 1/20 0.40
LMNA P02545 2/20 0.39
GAA P10253 2/20 0.39
POLB P06746 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
NPBWR1 P48145 1/20 0.38
ALOX15 P16050 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38

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
SCHEMBL2510094 0.87 KMT2A (0.44) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL2480091 0.86 KMT2A (0.48) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL2508926 0.86 KMT2A (0.43) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL2483320 0.86 KMT2A (0.43) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL2481446 0.85 KMT2A (0.43) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL2483534 0.83 KMT2A (0.45) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL2482517 0.83 PPARG (0.47) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL2507768 0.82 ALOX15 (0.56) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL2481807 0.81 CYP1A2 (0.40) KMT2AMEN1CYP3A4TDP1L3MBTL1
SCHEMBL2499782 0.81 PPARG (0.41) KMT2AMEN1CYP3A4TDP1L3MBTL1

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
US-8604235-B2 Production of substituted phenylene aromatic diesters and compositions DOW GLOBAL TECHNOLOGIES LLC (US) 2013-12-10 US disclosed
EP-2376423-A1 PRODUCTION OF SUBSTITUTED PHENYLENE AROMATIC DIESTERS Dow Global Technologies LLC (US) 2011-10-19 EP disclosed
WO-2010078519-A1 PRODUCTION OF SUBSTITUTED PHENYLENE AROMATIC DIESTERS DOW GLOBAL TECHNOLOGIES INC. (US) 2010-07-08 WO disclosed