SCHEMBL10817869

SCHEMBL10817869

CCOC(=O)C=C(N)C(OC)OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.47
ALOX15 P16050 1/20 0.41
HCAR2 Q8TDS4 1/20 0.39
ALDH1A1 P00352 4/20 0.34
MAPT P10636 1/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SOAT1 P35610 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CAD P27708 1/20 0.32
GLO1 Q04760 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
SCHEMBL10817860 1.00 NPSR1 (0.47) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL7379614 0.86 NPSR1 (0.48) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL7379617 0.86 NPSR1 (0.48) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL7902951 0.80 NPSR1 (0.50) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL2647130 0.80 NPSR1 (0.50) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL2647184 0.80 NPSR1 (0.50) NPSR1ALOX15HCAR2ALDH1A1MAPT
SCHEMBL10966894 0.80 TSHR (0.38) NPSR1HCAR2ALDH1A1MAPTHSD17B10
SCHEMBL6539020 0.79 HCAR2 (0.40) HCAR2
SCHEMBL11134387 0.79 HCAR2 (0.40) HCAR2
SCHEMBL6539016 0.79 HCAR2 (0.40) HCAR2

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-0063747-B1 2-SUBSTITUTED OR UNSUBSTITUTED AMINOCARBONYLOXYALKYL-1,4-DIHYDROPYRIDINES BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-12-09 EP disclosed
EP-0063359-B1 1,4-DIHYDROPYRIDINE DERIVATIVES AND PROCESSES FOR PREPARING THE SAME BANYU PHARMACEUTICAL CO., LTD. (JP) 1985-12-11 EP disclosed
US-4404378-A HYPOTENSIVE AGENTS; VASODILATION BANYU PHARMACEUTICAL CO., LTD. (JP) 1983-09-13 US disclosed
EP-0063747-A1 2-Substituted or unsubstituted aminocarbonyloxyalkyl-1,4-dihydropyridines BANYU PHARMACEUTICAL CO., LTD. (JP) 1982-11-03 EP disclosed
EP-0063359-A1 1,4-Dihydropyridine derivatives and processes for preparing the same BANYU PHARMACEUTICAL CO., LTD. (JP) 1982-10-27 EP disclosed