SCHEMBL7908950

SCHEMBL7908950

C=CC(=O)OC(=O)CC(=C)C(=O)OC(=O)/C=C\C(=O)OC(=O)C(=C)CC(=O)OC(=O)C=C

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.31
ALDH1A1 P00352 3/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
HSD17B10 Q99714 2/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 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
SCHEMBL7167538 0.94 TSHR (0.34) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL676004 0.85 HCAR2 (0.42) TSHRALDH1A1TP53HSD17B10ALOX15
SCHEMBL21628056 0.85 HCAR2 (0.42) TSHRALDH1A1TP53HSD17B10ALOX15
SCHEMBL9436059 0.84 HCAR2 (0.36) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL27525609 0.83 MGAM (0.37) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL8429818 0.82 ALDH1A1 (0.38) TSHRALDH1A1
SCHEMBL7866456 0.81
SCHEMBL3879634 0.79 HSD17B10 (0.52) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL27427766 0.79 HSD17B10 (0.52) TSHRALDH1A1TP53HIF1AHSD17B10
SCHEMBL8952274 0.78 HCAR2 (0.48) TSHRALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6197739-B1 LOW FOAMING DETERGENT ECOLAB INC. 2001-03-06 US disclosed
US-6017872-A Compositions and process for cleaning and finishing hard surfaces ECOLAB INC. (US) 2000-01-25 US disclosed
EP-0964056-A2 Compositions and process for cleaning and finishing hard surfaces ECOLAB INC. (US) 1999-12-15 EP disclosed
US-5861366-A NONIONIC SURFACTANT WITH BUILDERS AND WATER CONDITIONERS ECOLAB INC. (US) 1999-01-19 US disclosed
US-5858117-A CLEANING FOOD PROCESSING UNIT HAVING PROTEINACEOUS RESIDUES BY CONTACTING WITH LOW FOAMING PROTEASE ENZYME DETERGENT TO REMOVE SOIL, DENATURING ENZYME WITH OXIDIZING AGENT ECOLAB INC. (US) 1999-01-12 US disclosed
EP-0778880-B1 IMPROVED PROTEOLYTIC ENZYME CLEANER ECOLAB INC (US) 1998-10-14 EP disclosed
EP-0778880-A2 IMPROVED PROTEOLYTIC ENZYME CLEANER ECOLAB INC. (US) 1997-06-18 EP disclosed
WO-1996006910-A2 IMPROVED PROTEOLYTIC ENZYME CLEANER ECOLAB INC. (US) 1996-03-07 WO disclosed