SCHEMBL10795656

SCHEMBL10795656

CCC(=O)OC1=CC(=O)CC(C)(C)C1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
MAPT P10636 4/20 0.57
HPGD P15428 4/20 0.57
KMT2A Q03164 3/20 0.57
GAA P10253 3/20 0.45
LMNA P02545 3/20 0.45
KDM4E B2RXH2 2/20 0.45
TSHR P16473 1/20 0.39
POLB P06746 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 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
SCHEMBL6072475 0.82 KMT2A (0.50) ALDH1A1MAPTHPGDKMT2AGAA
SCHEMBL9298611 0.79 KMT2A (0.56) ALDH1A1MAPTHPGDKMT2AGAA
SCHEMBL9196237 0.77 HPGD (0.57) ALDH1A1MAPTHPGDKMT2AGAA
SCHEMBL20267222 0.76 MAPT (0.35) ALDH1A1MAPTHPGDKMT2A
SCHEMBL1128004 0.75 ALDH1A1 (0.47) ALDH1A1MAPTHPGDKMT2AGAA
SCHEMBL14501302 0.75 KMT2A (0.52) ALDH1A1MAPTHPGDKMT2AGAA
SCHEMBL25440299 0.74 KMT2A (0.76) ALDH1A1MAPTHPGDKMT2AGAA
SCHEMBL25440183 0.73 MAPT (0.78) ALDH1A1MAPTHPGDKMT2AGAA
SCHEMBL25440072 0.73 KMT2A (1.00) ALDH1A1MAPTHPGDKMT2AGAA
SCHEMBL124904 0.72 ALDH1A1 (0.51) ALDH1A1MAPTHPGDKMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE32489-E Herbicidal substituted 2-(1-(oxyamino)-alkylidene)-cyclohexane-1,3-diones CHEVRON RESEARCH COMPANY (US) 1987-09-01 US disclosed
US-4440566-A Herbicidal substituted 2-(1-(oxyamino)-alkylidene)-cyclohexane-1,3-diones CHEVRON RESEARCH COMPANY (US) 1984-04-03 US disclosed