SCHEMBL19019181

SCHEMBL19019181

CC(C(=O)Nc1cc(C(=O)Nc2nnc(-c3ccccc3)s2)ccc1CS(C)(=O)=O)N1CCNCC1

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 20/20 0.84

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
SCHEMBL16119670 0.91 WNT3A (1.00) WNT3A
SCHEMBL16102080 0.91 WNT3A (1.00) WNT3A
SCHEMBL19019182 0.88 WNT3A (0.66) WNT3A
Trifluoroacetic Acid SCHEMBL18045637 0.87 WNT3A (0.91) WNT3A
SCHEMBL16103261 0.84 WNT3A (0.73) WNT3A
SCHEMBL16102995 0.79 WNT3A (0.73) WNT3A
SCHEMBL16101843 0.78 WNT3A (1.00) WNT3A
SCHEMBL19019566 0.78 WNT3A (0.76) WNT3A
SCHEMBL16100749 0.78 WNT3A (1.00) WNT3A
SCHEMBL16102273 0.77 WNT3A (0.64) WNT3A

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-2976327-B1 3-ACETYLAMINO-1-(PHENYL-HETEROARYL-AMINOCARBONYL OR PHENYL-HETEROARYL-CARBONYLAMINO)BENZENE DERIVATIVES FOR THE TREATMENT OF HYPERPROLIFERATIVE DISORDERS Bayer Pharma AG (DE) 2017-06-21 EP disclosed