SCHEMBL5086167

SCHEMBL5086167

CC1(C)CC(O)CC(C)(C)N1OC(=O)CCC(=O)OCCO

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
ADRA2A P08913 1/20 0.33
ADRA1A P35348 1/20 0.33
MGLL Q99685 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
EPHX2 P34913 1/20 0.32

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
SCHEMBL28364620 0.87 KMT2A (0.40) MEN1GAAKMT2A
SCHEMBL8503955 0.81 KMT2A (0.44) MEN1GAAKMT2AEPHX2
SCHEMBL23850586 0.80 KMT2A (0.43) MEN1GAAKMT2AEPHX2
SCHEMBL8148909 0.78 CYP4F2 (0.34)
SCHEMBL28938416 0.75 KMT2A (0.38) MEN1GAAKMT2A
SCHEMBL3864411 0.75 MEN1 (0.40) MEN1GAAKMT2AEPHX2
SCHEMBL22462378 0.73 KMT2A (0.32) MEN1GAAKMT2A
SCHEMBL23074471 0.72 EPHX2 (0.33) KMT2AMGLLEPHX2
SCHEMBL5080961 0.72 CYP2D6 (0.31)
Succinic Acid Diethyl Ester SCHEMBL250757 0.71 TSHR (0.37) GAAKMT2AEPHX2

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-110049869-B Extruded matte foil with improved mechanical properties and high weatherability 罗姆化学有限责任公司 2021-05-07 CN disclosed
WO-2008040482-A1 POLYOLEFIN COMPOSITION WITH INCREASED RESISTANCE TO CIO2-CONTAINING WATER BOREALIS TECHNOLOGY OY (FI) 2008-04-10 WO disclosed
WO-2007050675-A1 ULTRAVIOLET LIGHT ABSORBING COMPOSITION CRYOVAC, INC. (US) 2007-05-03 WO disclosed
US-4785107-A OXIDATION RESISTANT STABILIZERS FOR POLYOLEFINS BASF AKTIENGESELLSCHAFT (DE) 1988-11-15 US disclosed