SCHEMBL10415664

SCHEMBL10415664

O=C(O)C(=O)ON1CCC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL5857825 0.94 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5855885 0.92 ALDH1A1 (0.36) ALDH1A1
SCHEMBL27608439 0.88 ALDH1A1 (0.33) ALDH1A1
SCHEMBL3717460 0.82 ALDH1A1 (0.35) ALDH1A1
SCHEMBL2483464 0.80 ALDH1A1 (0.39) ALDH1A1
Water SCHEMBL11439691 0.78 ALDH1A1 (0.38) ALDH1A1
SCHEMBL9596551 0.77 TDP1 (0.41) ALDH1A1
SCHEMBL29200488 0.77 HSD17B10 (0.40) ALDH1A1
SCHEMBL10578838 0.77 ALDH1A1 (0.33) ALDH1A1
SCHEMBL27860248 0.76

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-4939253-A 2-oxoazetidin-1-yloxy acetic acids and analogs E. R. SQUIBB & SONS, INC. (US) 1990-07-03 US disclosed