SCHEMBL9751369

SCHEMBL9751369

CCC(=O)C1C(=O)CC2(C(=O)OC)CCCC2C1=O

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 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
SCHEMBL9751435 0.91 GAA (0.37) KDM4EALDH1A1POLBMAPTTSHR
SCHEMBL9751480 0.83 GAA (0.38) KDM4EALDH1A1POLBMAPTTSHR
SCHEMBL9751501 0.80 ALDH1A1 (0.33) KDM4EALDH1A1
SCHEMBL9751419 0.77 ALDH1A1 (0.34) KDM4EALDH1A1
SCHEMBL9751376 0.73 HTT (0.33) MAPT
SCHEMBL9751417 0.72 ALDH1A1 (0.33) ALDH1A1
SCHEMBL9751429 0.70 GAA (0.39) KDM4EALDH1A1POLBMAPTTSHR
SCHEMBL9751420 0.70 GAA (0.36) KDM4EALDH1A1POLBMAPTTSHR
SCHEMBL9751361 0.68
SCHEMBL1709532 0.64 CYP3A4 (0.45) ALDH1A1POLBMAPTTSHR

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
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
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