SCHEMBL23715980

SCHEMBL23715980

NC(O)C(NNOC1=CCC=CC=C1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 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
SCHEMBL23716123 0.73 AOC3 (0.42) AOC3
SCHEMBL23715928 0.65 IDO1 (0.39) AOC3
SCHEMBL23716036 0.59 AOC3 (0.50) AOC3
SCHEMBL19248307 0.58 CA1 (0.43)
SCHEMBL23715805 0.57 SLC7A5 (0.37)
SCHEMBL23716117 0.57 OGG1 (0.38) AOC3
SCHEMBL21251398 0.56 IDO1 (0.41)
SCHEMBL10904062 0.55
SCHEMBL5278765 0.55 MEN1 (0.30)
SCHEMBL22273536 0.53

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-3209732-B1 SPHINGOSINE-1-PHOSPATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS SCRIPPS RESEARCH INST (US) 2021-08-04 EP disclosed