SCHEMBL9316256

SCHEMBL9316256

[CH2]C(C)(CCCOCC)OCC

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL7527281 0.83 ALDH1A1 (0.32) ALDH1A1
SCHEMBL13195976 0.75 ALDH1A1 (0.36) ALDH1A1
SCHEMBL10290463 0.74 HRH3 (0.43) ALDH1A1
SCHEMBL10632587 0.71 ALDH1A1 (0.33) ALDH1A1
SCHEMBL18028838 0.70 ALDH1A1 (0.43) ALDH1A1
SCHEMBL14983309 0.70 ALDH1A1 (0.36) ALDH1A1
SCHEMBL5611803 0.70 ALDH1A1 (0.36) ALDH1A1
SCHEMBL11551647 0.69
SCHEMBL12380904 0.67 ALDH1A1 (0.38) ALDH1A1
SCHEMBL12380905 0.67 CYP4F2 (0.40) ALDH1A1

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
EP-0625975-A1 CYCLOHEXENONE OXIME ETHERS, PROCESS FOR MAKING THEM AND THEIR USE AS HERBICIDES. BASF AG (DE) 1994-11-30 EP disclosed
WO-1993016063-A1 CYCLOHEXENONE OXIME ETHERS, PROCESS FOR MAKING THEM AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-08-19 WO disclosed