SCHEMBL8617864

SCHEMBL8617864

C=C(CC=CC(=O)O)C(=O)OC.C=CC(=O)NCO

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HCAR2 Q8TDS4 1/20 0.30

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
Acrylic Acid SCHEMBL8951871 0.86 ALOX15 (0.41) ALDH1A1TSHRTDP1ALOX15HSD17B10
SCHEMBL239948 0.84 HCAR2 (0.40) ALDH1A1TSHRTDP1EGLN1ALOX15
Butadiene SCHEMBL11340927 0.83 HCAR2 (0.36) ALDH1A1TSHRTDP1ALOX15HSD17B10
Acrylic Acid Methyl Ester SCHEMBL1474305 0.82 HCAR2 (0.41) ALDH1A1TSHRTDP1ALOX15HSD17B10
1,1-Dichloroethene SCHEMBL7050642 0.80 HCAR2 (0.36) ALDH1A1TSHRTDP1HCAR2
Methacrylic Acid SCHEMBL1219401 0.79 ALDH1A1 (0.42) ALDH1A1TSHRTDP1ALOX15HSD17B10
SCHEMBL1473949 0.79 ALDH1A1 (0.52) ALDH1A1TSHRTDP1ALOX15HSD17B10
Acrylic Acid Methyl Ester SCHEMBL8516207 0.78 HCAR2 (0.38) ALDH1A1ALOX15HSD17B10HCAR2
SCHEMBL4530367 0.78 TSHR (0.51) ALDH1A1TSHRMAPK1HSD17B10HCAR2
Acrylic Acid SCHEMBL10336780 0.77 ALDH1A1 (0.50) ALDH1A1TSHRMAPK1TDP1ZDHHC20

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0320821-B1 Silver halide color photographic material FUJI PHOTO FILM CO LTD (JP) 1998-05-13 EP disclosed
US-4978606-A CONTAINING HYDROQUINONES AND SULFONAMIDOPHENOLS; STORAGE STABILITY FUJI PHOTO FILM CO., LTD. (JP) 1990-12-18 US disclosed
EP-0320821-A2 Silver halide color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1989-06-21 EP disclosed