SCHEMBL28027633

SCHEMBL28027633

CC(C)(C)OC(=O)NCCNC(=O)c1ccccc1C(=O)NCCNC(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.56
MALT1 Q9UDY8 1/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
HCRTR1 O43613 2/20 0.51
BCHE P06276 1/20 0.51
IDO1 P14902 1/20 0.50
TDP1 Q9NUW8 1/20 0.47
DRD2 P14416 1/20 0.46
KDM4A O75164 1/20 0.46
CXCR2 P25025 1/20 0.45
MEN1 O00255 1/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 1/20 0.45
NQO2 P16083 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45

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
SCHEMBL1657927 0.91 ESRRG (0.56) KCNA5MALT1TSHRHTTHCRTR1
SCHEMBL4059012 0.90 HPGD (0.56) KCNA5MALT1HTTHCRTR1BCHE
SCHEMBL14690580 0.88 CRBN (0.51) KCNA5MALT1TSHRHTTHCRTR1
SCHEMBL9743749 0.88 KCNA5 (0.56) KCNA5MALT1TSHRHTTHCRTR1
SCHEMBL9540574 0.87 KCNA5 (0.58) KCNA5MALT1TSHRHTTHCRTR1
SCHEMBL1754810 0.85 POLB (0.58) MALT1BCHEIDO1GAA
SCHEMBL22880704 0.84 NPC1 (0.52) KCNA5TSHRHTTHCRTR1TDP1
SCHEMBL1584128 0.83 MEN1 (0.54) KCNA5TSHRHTTBCHEIDO1
SCHEMBL14691000 0.83 KCNA5 (0.46) KCNA5MALT1HCRTR1BCHEIDO1
SCHEMBL14691066 0.82 DRD2 (0.45) KCNA5MALT1TSHRBCHEIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102942566-B Dimerization and trimerization nucleic acid dye and relevant system and method BIOTIUM INC. (US) 2016-04-20 CN disclosed
CN-101142326-B Dimeric and trimeric nucleic acid dyes and related systems and methods BIOTIUM, INC. (US) 2015-09-30 CN disclosed