SCHEMBL11277517

SCHEMBL11277517

COC(=O)N=C(OC)SC

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
PKM P14618 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
SCHEMBL7575929 0.81 ALDH1A1 (0.39) ALDH1A1
SCHEMBL11282936 0.81 GAA (0.38) ALDH1A1
SCHEMBL15866679 0.80
SCHEMBL19114487 0.78
SCHEMBL1862861 0.77 ALDH1A1 (0.32) ALDH1A1PKM
SCHEMBL11325603 0.76
SCHEMBL13188482 0.76
SCHEMBL11282111 0.73
SCHEMBL8134503 0.73
SCHEMBL11247187 0.73

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-4353913-A ANTHELMINTICS BAYER AKTIENGESELLSCHAFT (DE) 1982-10-12 US disclosed