SCHEMBL8630907

SCHEMBL8630907

CCCCN(CCO)C(C)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.50
CA1 P00915 3/20 0.50
CA9 Q16790 3/20 0.50
MMP1 P03956 1/20 0.47
MMP2 P08253 1/20 0.47
MMP3 P08254 1/20 0.47
MMP8 P22894 1/20 0.47
ALDH1A1 P00352 3/20 0.40
ALDH2 P05091 1/20 0.40
CA2 P00918 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.35
CES1 P23141 1/20 0.34

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
SCHEMBL22986005 0.91 CA12 (0.45) CA12CA1CA9MMP1MMP2
SCHEMBL8631840 0.91 CA12 (0.50) CA12CA1CA9MMP1MMP2
SCHEMBL497913 0.91 CA12 (0.58) CA12CA1CA9MMP1MMP2
SCHEMBL8633186 0.89 CA12 (0.48) CA12CA1CA9MMP1MMP2
Hydrochloric Acid SCHEMBL3023639 0.88 CA12 (0.56) CA12CA1CA9MMP1MMP2
SCHEMBL13055373 0.86 CA12 (0.54) CA12CA1CA9MMP1MMP2
SCHEMBL498627 0.86 CA12 (0.54) CA12CA1CA9MMP1MMP2
SCHEMBL8630891 0.86 CA12 (0.46) CA12CA1CA9ALDH1A1ALDH2
SCHEMBL8940796 0.85 MAPT (0.40) CA12CA1CA9ALDH1A1ALDH2
SCHEMBL474902 0.85 MAPT (0.40) CA12CA1CA9ALDH1A1ALDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5851274-A Ink jet ink compositions and processes for high resolution and high speed printing XEROX CORPORATION (US) 1998-12-22 US claimed
EP-0853107-A1 Ink jet ink compositions comprising hydroxyamide derivatives and printing processes XEROX CORPORATION (US) 1998-07-15 EP claimed
EP-0853108-A1 Ink jet ink compositions and processes for high resolution and high speed printing XEROX CORPORATION (US) 1998-07-15 EP claimed
US-5693129-A AQUEOUS MIXCTURE CONTAINING COLORING AND A HYDROXYAMIDE, THIOAMIDE, MERCAPTOAMIDE, MERCAPTOTHIOAMIDE OR AN OXYALKYLENE OR A THIOALKYLENE REACTION PRODUCT OF THE AMIDES, FOR HIGH RESOLUTION, REDUCED CURLING XEROX CORPORATION (US) 1997-12-02 US claimed
US-20240191095-A1 CAN INNER SURFACE COATING MATERIAL AND CAN WITH COATED INNER SURFACE TOYO INK SC HOLDINGS CO., LTD. (JP) 2024-06-13 US disclosed
US-5851274-A Ink jet ink compositions and processes for high resolution and high speed printing XEROX CORPORATION (US) 1998-12-22 US disclosed
EP-0853107-A1 Ink jet ink compositions comprising hydroxyamide derivatives and printing processes XEROX CORPORATION (US) 1998-07-15 EP disclosed
EP-0853108-A1 Ink jet ink compositions and processes for high resolution and high speed printing XEROX CORPORATION (US) 1998-07-15 EP disclosed
US-5693129-A AQUEOUS MIXCTURE CONTAINING COLORING AND A HYDROXYAMIDE, THIOAMIDE, MERCAPTOAMIDE, MERCAPTOTHIOAMIDE OR AN OXYALKYLENE OR A THIOALKYLENE REACTION PRODUCT OF THE AMIDES, FOR HIGH RESOLUTION, REDUCED CURLING XEROX CORPORATION (US) 1997-12-02 US disclosed