SCHEMBL7695909

SCHEMBL7695909

C[C](C)CC(=O)OC1COC1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
NAAA Q02083 2/20 0.31
ACACB O00763 1/20 0.31
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 1/20 0.30

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
SCHEMBL7430516 0.88 MGAM (0.44) NAAAACACBMGAMGAASI
SCHEMBL16161014 0.78
SCHEMBL20954600 0.76
SCHEMBL7687519 0.75 NAAA (0.46) ALDH1A1NAAA
SCHEMBL7691565 0.75
SCHEMBL22616045 0.75 ALDH1A1 (0.33) ALDH1A1
SCHEMBL27921573 0.74
SCHEMBL7690741 0.74
SCHEMBL7687516 0.73 NAAA (0.30) NAAA
SCHEMBL7695912 0.73 MMP1 (0.37) ALDH1A1ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6337305-B1 HERBICIDES FOR AGRICULTURE BASF AKTIENGESELLSCHAFT (DE) 2002-01-08 US disclosed