SCHEMBL452901

SCHEMBL452901

CCCOC(=O)CN(O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.40
DGKA P23743 1/20 0.40
ALDH1A1 P00352 6/20 0.39
HCAR2 Q8TDS4 1/20 0.39
DNM1 Q05193 1/20 0.37
LMNA P02545 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
ESR1 P03372 1/20 0.35
CHRM1 P11229 1/20 0.35
TSHR P16473 1/20 0.35
SLC6A2 P23975 1/20 0.35
KDR P35968 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
RAD52 P43351 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
PPM1B O75688 1/20 0.34
PTPN1 P18031 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
SCHEMBL456028 0.86 ALDH1A1 (0.52) NAAADGKAALDH1A1HCAR2DNM1
SCHEMBL26313 0.81 DNM1 (0.46) NAAADGKAALDH1A1HCAR2DNM1
SCHEMBL25917458 0.81 DNM1 (0.41) NAAADGKAALDH1A1HCAR2DNM1
SCHEMBL450298 0.80
SCHEMBL27614133 0.79 DNM1 (0.40) NAAADGKAALDH1A1HCAR2DNM1
SCHEMBL19031305 0.79 CA12 (0.39) NAAADGKAALDH1A1HCAR2DNM1
SCHEMBL12483580 0.79 TDP1 (0.42) NAAADGKAALDH1A1HCAR2DNM1
SCHEMBL19454684 0.79 DNM1 (0.37) NAAADGKAALDH1A1HCAR2DNM1
SCHEMBL2840542 0.76 CA12 (0.46) NAAADGKAALDH1A1HCAR2DNM1
SCHEMBL1967964 0.74 CA12 (0.48) NAAADGKAALDH1A1HCAR2DNM1

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
US-9126178-B2 Heat-expandable microspheres and a method of making heat-expandable microspheres and application thereof MATSUMOTO YUSHI-SEIYAKU CO., LTD. (JP) 2015-09-08 US disclosed
EP-2529830-A2 Heat-expandable microspheres and a method of making heat-expandable microspheres and application thereof MATSUMOTO YUSHI-SEIYAKU CO., LTD. (JP) 2012-12-05 EP disclosed
EP-2441814-A1 HEAT-EXPANDABLE MICROSPHERE, METHOD FOR PRODUCING SAME AND USE OF SAME Matsumoto Yushi-Seiyaku Co., Ltd. (JP) 2012-04-18 EP disclosed
US-20120064347-A1 HEAT-EXPANDABLE MICROSPHERES AND A METHOD OF MAKING HEAT-EXPANDABLE MICROSPHERES AND APPLICATION THEREOF MATSUMOTO YUSHI-SEIYAKU CO., LTD. (JP) 2012-03-15 US disclosed