SCHEMBL9034130

SCHEMBL9034130

COC(=O)C(N[C]=O)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
CA14 Q9ULX7 2/20 0.34
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 1/20 0.32
KMT2A Q03164 1/20 0.32
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
SCHEMBL3665543 0.78 MGAM (0.42) CA12CA1CA2CA9KMT2A
SCHEMBL3498478 0.77
SCHEMBL5638641 0.77
SCHEMBL8610882 0.73 CA14 (0.52) SMN1; SMN2CA14CA12CA9KMT2A
SCHEMBL3201070 0.73 CA14 (0.52) SMN1; SMN2CA14CA12CA9KMT2A
SCHEMBL6008014 0.72 CA1 (0.39) SMN1; SMN2CA14CA1CA2
SCHEMBL3486105 0.72 MME (0.39) SMN1; SMN2CA14CA1CA2KMT2A
SCHEMBL2702421 0.72 MME (0.39) SMN1; SMN2CA14CA1CA2KMT2A
SCHEMBL3485837 0.72 CA14 (0.41) SMN1; SMN2CA14CA12CA9
SCHEMBL9033590 0.72 SMN1; SMN2 (0.37) SMN1; SMN2CA14CA12CA1CA2

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
EP-0705835-A1 Quinoxalic-2,3-diones with an oxa or thiaheterocyclic fused ring CIBA-GEIGY AG (CH) 1996-04-10 EP disclosed