SCHEMBL28022592

SCHEMBL28022592

CC(C)(C)c1cc(CCC(=O)N2CN(C(=O)CCc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)CN(C(=O)CCc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)C2)cc(C(C)(C)C)c1O.[H+]

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.67
MEN1 O00255 4/20 0.67
GAA P10253 5/20 0.56
MAOB P27338 2/20 0.45
MAOA P21397 1/20 0.45
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 3/20 0.44
MAPT P10636 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
USP2 O75604 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
BLM P54132 1/20 0.43
ATM Q13315 1/20 0.43
HIF1A Q16665 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL78349 0.98 KMT2A (0.69) KMT2AMEN1GAAMAOBMAOA
SCHEMBL10963429 0.89 KMT2A (0.69) KMT2AMEN1GAAMAOBMAOA
SCHEMBL7185809 0.89 KMT2A (0.59) KMT2AMEN1GAAMAOBMAOA
SCHEMBL28493854 0.89 KMT2A (0.62) KMT2AMEN1GAAMAOBMAOA
SCHEMBL8077617 0.87 KMT2A (0.66) KMT2AMEN1GAAMAOBMAOA
SCHEMBL6360904 0.84 KMT2A (0.63) KMT2AMEN1GAAMAOBMAOA
SCHEMBL8608828 0.83 GAA (0.65) KMT2AMEN1GAAMAOBMAOA
SCHEMBL10999565 0.80 KMT2A (0.49) KMT2AMEN1GAAALDH1A1KDM4E
SCHEMBL28925050 0.79 KMT2A (0.57) KMT2AMEN1GAAMAOBMAOA
SCHEMBL11520659 0.79 GAA (0.68) KMT2AMEN1GAAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103232628-B The manufacture method of a kind of halogen-free flame-retardant thermal shrinkage material and thermal contraction casing tube CHINA NUCLEAR POWER ENGINEERING CO., LTD. (CN) 2015-11-04 CN claimed
CN-103232627-B Manufacture method of thermal contraction injection moulding CHINA NUCLEAR POWER ENG CO LTD 2015-06-17 CN claimed
CN-103232628-B The manufacture method of a kind of halogen-free flame-retardant thermal shrinkage material and thermal contraction casing tube CHINA NUCLEAR POWER ENGINEERING CO., LTD. (CN) 2015-11-04 CN disclosed
CN-103232627-B Manufacture method of thermal contraction injection moulding CHINA NUCLEAR POWER ENG CO LTD 2015-06-17 CN disclosed