SCHEMBL9511998

SCHEMBL9511998

CC(=O)CC(C(C)=O)(C(C)=O)C(N)(N)C(C)=O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.30
TDP1 Q9NUW8 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
SCHEMBL6251924 0.74 ALDH1A1 (0.33) ALDH1A1TDP1
SCHEMBL7914255 0.70 ALDH1A1 (0.31) ALDH1A1TDP1
SCHEMBL3640659 0.67 ALDH1A1 (0.37) ALDH1A1TDP1
SCHEMBL690783 0.67
SCHEMBL27722359 0.65
SCHEMBL27712791 0.65
SCHEMBL15834500 0.65
SCHEMBL6441472 0.65 ALDH1A1 (0.30) ALDH1A1TDP1
SCHEMBL4649993 0.64 ALDH1A1 (0.39) ALDH1A1TDP1
SCHEMBL10571434 0.64 ALDH1A1 (0.39) ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0479788-B1 PACKAGED LIQUID CLEANING PRODUCT UNILEVER PLC (GB) 1993-11-10 EP disclosed
EP-0479788-A1 PACKAGED LIQUID CLEANING PRODUCT. UNILEVER PLC (GB) 1992-04-15 EP disclosed
WO-1990012864-A1 PACKAGED LIQUID CLEANING PRODUCT UNILEVER NV (NL) 1990-11-01 WO disclosed