SCHEMBL9751420

SCHEMBL9751420

CCCC(=O)C1C(=O)CC2(C(=O)OC)CC(C)CC2C1=O

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL9751480 0.81 GAA (0.38) GAAHSD17B10KDM4EALDH1A1POLB
SCHEMBL9751371 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL9751435 0.80 GAA (0.37) GAAHSD17B10KDM4EALDH1A1POLB
SCHEMBL9751429 0.76 GAA (0.39) GAAHSD17B10KDM4EALDH1A1POLB
SCHEMBL9751381 0.74 KDM4E (0.32) KDM4EALDH1A1
SCHEMBL9751369 0.70 KDM4E (0.31) KDM4EALDH1A1POLBMAPTTSHR
SCHEMBL9751506 0.69 ALDH1A1 (0.30) ALDH1A1
SCHEMBL8793906 0.67 SMN1; SMN2 (0.52) GAAHSD17B10KDM4EALDH1A1POLB
SCHEMBL9751349 0.66
SCHEMBL9396153 0.64 ALDH1A1 (0.76) GAAHSD17B10KDM4EALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0422040-A4 HERBICIDAL BICYCLIC 1,3-DIKETONE DERIVATIVES 1991-08-07 EP claimed
EP-0422040-A1 HERBICIDAL BICYCLIC 1,3-DIKETONE DERIVATIVES DUNLENA PTY. LIMITED (AU) 1991-04-17 EP claimed
WO-1989012041-A1 HERBICIDAL BICYCLIC 1,3-DIKETONE DERIVATIVES DUNLENA PTY. LIMITED (AU) 1989-12-14 WO claimed
EP-0422040-A4 HERBICIDAL BICYCLIC 1,3-DIKETONE DERIVATIVES 1991-08-07 EP disclosed
US-5013843-A Zeolite catalyst, large scale, continuous process NEPERA, INC. (US) 1991-05-07 US disclosed
EP-0422040-A1 HERBICIDAL BICYCLIC 1,3-DIKETONE DERIVATIVES DUNLENA PTY. LIMITED (AU) 1991-04-17 EP disclosed
WO-1989012041-A1 HERBICIDAL BICYCLIC 1,3-DIKETONE DERIVATIVES DUNLENA PTY. LIMITED (AU) 1989-12-14 WO disclosed