SCHEMBL17679502

SCHEMBL17679502

C=C(C)C(=O)OCCNC(=O)OCCCCCCOc1ccccc1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.50
ALDH1A1 P00352 7/20 0.50
GAA P10253 2/20 0.49
KMT2A Q03164 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
MEN1 O00255 1/20 0.46
POLB P06746 2/20 0.46
HTT P42858 3/20 0.46
APEX1 P27695 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL17679501 1.00 KDM4E (0.50) KDM4EALDH1A1GAAKMT2AL3MBTL1
SCHEMBL17679500 0.93 KDM4E (0.51) KDM4EALDH1A1GAAKMT2AL3MBTL1
SCHEMBL2339053 0.93 POLB (0.46) KDM4EALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL29315515 0.90 KDM4E (0.56) KDM4EALDH1A1GAAKMT2AL3MBTL1
SCHEMBL18623998 0.89 KDM4E (0.48) KDM4EALDH1A1GAAKMT2AL3MBTL1
SCHEMBL13380545 0.87 KDM4E (0.44) KDM4EALDH1A1GAAKMT2AL3MBTL1
SCHEMBL2337516 0.86 MTNR1A (0.43) KDM4EALDH1A1KMT2AL3MBTL1SMN1; SMN2
SCHEMBL19009179 0.86 POLB (0.42) ALDH1A1SMN1; SMN2POLBHTTAPEX1
SCHEMBL29315511 0.86 KDM4E (0.54) KDM4EALDH1A1GAAKMT2AL3MBTL1
SCHEMBL17350453 0.85 KDM4E (0.45) KDM4EALDH1A1GAAKMT2AL3MBTL1

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
EP-3006517-B1 COPOLYMER, AQUEOUS INK, AND INK CARTRIDGE RICOH CO LTD (JP) 2017-02-01 EP disclosed
US-9365670-B2 Copolymer, aqueous ink, and ink cartridge RICOH COMPANY, LTD. (JP) 2016-06-14 US disclosed
US-20160102162-A1 COPOLYMER, AQUEOUS INK, AND INK CARTRIDGE RICOH COMPANY, LTD. (JP) 2016-04-14 US disclosed