SCHEMBL7513046

SCHEMBL7513046

C=C(CC)C(=O)OC(=O)CCC(=O)OC(=O)C(=C)CC

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
TSHR P16473 2/20 0.38
TDP1 Q9NUW8 3/20 0.31
HSD17B10 Q99714 1/20 0.31
FFAR3 O14843 1/20 0.30
THRB P10828 1/20 0.30
ADRA2A P08913 1/20 0.30
ADRA1A P35348 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
SCHEMBL7518253 0.91 TSHR (0.42) ALDH1A1TSHR
SCHEMBL7515764 0.91 ALDH1A1 (0.42) ALDH1A1TSHRTDP1
SCHEMBL1923846 0.84 ALDH1A1 (0.37) ALDH1A1TSHRTDP1HSD17B10FFAR3
SCHEMBL28645587 0.83 DGKA (0.52) ALDH1A1TSHRTDP1HSD17B10
SCHEMBL29187200 0.83 DGKA (0.52) ALDH1A1TSHRTDP1HSD17B10
SCHEMBL8995711 0.83 DGKA (0.52) ALDH1A1TSHRTDP1HSD17B10
SCHEMBL8953258 0.81 ALDH1A1 (0.35) ALDH1A1TSHRTDP1HSD17B10FFAR3
SCHEMBL322891 0.81 TSHR (0.42) ALDH1A1TSHRHSD17B10
SCHEMBL4951117 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL2210522 0.79 MGAM (0.46) ALDH1A1TSHRTDP1HSD17B10THRB

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-0487084-B1 Image forming method and apparatus CANON KK (JP) 2002-01-30 EP disclosed
US-5864406-A Method and apparatus for forming halftone images on organic-silver-salt-based printing plates CANON KABUSHIKI KAISHA (JP) 1999-01-26 US disclosed
US-5529889-A CONTAINING CYANINE COMPOUND CANON KABUSHIKI KAISHA (JP) 1996-06-25 US disclosed
EP-0559101-A1 Heat-developable photosensitive material and image forming method which uses the same CANON KABUSHIKI KAISHA (JP) 1993-09-08 EP disclosed
EP-0487084-A2 Image forming method and apparatus CANON KABUSHIKI KAISHA (JP) 1992-05-27 EP disclosed