SCHEMBL12401987

SCHEMBL12401987

C=CCOCC(O)CN(CCO)CCO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.52
CA2 P00918 5/20 0.52
CA7 P43166 4/20 0.52
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 2/20 0.39
GAA P10253 3/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CA9 Q16790 4/20 0.37
CA4 P22748 3/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
TSHR P16473 2/20 0.33
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31

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
SCHEMBL14647474 0.96 CA1 (0.52) CA1CA2CA7ALDH1A1KDM4E
SCHEMBL15829088 0.88 CA1 (0.44) CA1CA2CA7ALDH1A1KDM4E
SCHEMBL27092923 0.83 CA1 (0.49) CA1CA2CA7KDM4ELMNA
SCHEMBL2849092 0.82 CA1 (0.52) CA1CA2CA7ALDH1A1CA9
SCHEMBL3076289 0.81 CA1 (0.55) CA1CA2CA7ALDH1A1CA9
SCHEMBL23615805 0.80 ALDH1A1 (0.47) CA1CA2CA7ALDH1A1KDM4E
SCHEMBL10412414 0.80 CA1 (0.46) CA1CA2CA7ALDH1A1LMNA
SCHEMBL10433266 0.80 CA1 (0.53) CA1CA2CA7LMNACA9
SCHEMBL19608962 0.79 CA1 (0.52) CA1CA2CA7KDM4EGAA
SCHEMBL11878116 0.78 CA1 (0.44) CA1CA2CA7KDM4ENPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3395909-B1 WATER-SOLUBLE FILM AND METHOD FOR MANUFACTURING SAME NIPPON CATALYTIC CHEM IND (JP) 2022-05-18 EP disclosed
US-10703895-B2 Water-soluble film and method for manufacturing same NIPPON SHOKUBAI CO., LTD. (JP) 2020-07-07 US disclosed
US-20190002683-A1 WATER-SOLUBLE FILM AND METHOD FOR MANUFACTURING SAME NIPPON SHOKUBAI CO., LTD. (JP) 2019-01-03 US disclosed
EP-3395909-A1 WATER-SOLUBLE FILM AND METHOD FOR MANUFACTURING SAME Nippon Shokubai Co., Ltd. (JP) 2018-10-31 EP disclosed
US-20110183880-A1 (METH) ACRYLIC ACID-BASED COPOLYMER, METHOD FOR PRODUCING THE SAME AND DETERGENT COMPOSITION USING THE SAME NIPPON SHOKUBAI CO., LTD (JP) 2011-07-28 US disclosed