SCHEMBL11677948

SCHEMBL11677948

CONC(=O)NC(=N)OC

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL8195640 0.77
SCHEMBL11677999 0.75 MAPK1 (0.31)
SCHEMBL11860691 0.74
SCHEMBL3077677 0.74
SCHEMBL6958199 0.74
SCHEMBL11678640 0.72 ALDH1A1 (0.33) ALDH1A1
SCHEMBL11674719 0.71 CA12 (0.38) ALDH1A1
SCHEMBL11675337 0.71 SMN1; SMN2 (0.37) ALDH1A1
SCHEMBL11675138 0.71
SCHEMBL11678397 0.71 TSHR (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4017529-A Herbicidal allophanimidates E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-04-12 US disclosed