SCHEMBL9679697

SCHEMBL9679697

CC=C(C)C(=CC)OCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
LMNA P02545 2/20 0.39
HSD17B10 Q99714 1/20 0.39
TRPA1 O75762 1/20 0.35
GLO1 Q04760 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
ALOX15 P16050 1/20 0.32
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
HCAR2 Q8TDS4 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
MEN1 O00255 1/20 0.31
S1PR4 O95977 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
SCHEMBL9679690 1.00 ALDH1A1 (0.39) ALDH1A1LMNAHSD17B10TRPA1GLO1
SCHEMBL18857230 0.74
SCHEMBL27339552 0.72 HCAR2 (0.36) ALDH1A1LMNAHSD17B10GLO1SMN1; SMN2
SCHEMBL15827577 0.70 ALDH1A1 (0.35) ALDH1A1TRPA1GLO1SOAT1NPSR1
SCHEMBL111294 0.70
SCHEMBL2261094 0.70
SCHEMBL15751128 0.70
SCHEMBL27535425 0.70
SCHEMBL7101348 0.70 NPSR1 (0.48) ALDH1A1LMNAHSD17B10TRPA1GLO1
SCHEMBL7101351 0.70 NPSR1 (0.48) ALDH1A1LMNAHSD17B10TRPA1GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5155240-A Process for producing optically active dihydropyran derivative TAKASAGO INTERNATIONAL CORPORATION (JP) 1992-10-13 US disclosed