SCHEMBL6403901

SCHEMBL6403901

O=C(O)CC(O)CCOCCC(O)CC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.57
GPR84 Q9NQS5 4/20 0.48
GABRR1 P24046 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.43
MMP12 P39900 6/20 0.40
MMP13 P45452 6/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP14 P50281 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL6803990 0.83 GPR84 (0.68) GPR84MAPT
SCHEMBL9169806 0.81 SLC22A6 (0.52) SLC22A6GPR84GABRR1LMNAMAPT
SCHEMBL26138089 0.81 SLC22A6 (0.75) SLC22A6GPR84GABRR1LMNAMAPT
SCHEMBL3089526 0.78 SLC22A6 (0.71) SLC22A6GPR84GABRR1LMNAMAPT
SCHEMBL3810677 0.78 MMP12 (0.55) MMP12MMP13MMP2MMP9MMP14
SCHEMBL4611958 0.78 MMP12 (0.55) MMP12MMP13MMP2MMP9MMP14
SCHEMBL27336823 0.77
SCHEMBL2593815 0.76 SLC22A6 (0.46) SLC22A6GPR84GABRR1LMNAMAPT
SCHEMBL966415 0.76 GPR84 (0.74) SLC22A6GPR84GABRR1LMNAMAPT
SCHEMBL28922166 0.76 GPR84 (0.67) SLC22A6GPR84GABRR1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6939960-B2 Cellulose ethers WOLFF WALSRODE AG (DE) 2005-09-06 US disclosed
US-20030032798-A1 Novel cellulose ethers DOW GLOBAL TECHNOLOGIES LLC 2003-02-13 US disclosed
US-6482940-B1 Cellulose ethers and method for producing the same WOLFF WALSRODE AG (DE) 2002-11-19 US disclosed
EP-0996641-B1 NOVEL CELLULOSE ETHERS AND METHOD FOR PRODUCING THE SAME WOLFF WALSRODE AG (DE) 2001-06-27 EP disclosed
EP-0996641-A1 NOVEL CELLULOSE ETHERS AND METHOD FOR PRODUCING THE SAME Wolff Walsrode AG (DE) 2000-05-03 EP disclosed
WO-1999003891-A1 NOVEL CELLULOSE ETHERS AND METHOD FOR PRODUCING THE SAME WOLFF WALSRODE AG (DE) 1999-01-28 WO disclosed