SCHEMBL19982260

SCHEMBL19982260

COC(=O)C(Cc1ccc(OC)cc1)NC(=O)CC1CCN(C(=O)CCc2ccc(C#N)cc2)CC1

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 15/20 0.82
IL2RA P01589 1/20 0.47
ALB P02768 1/20 0.47
IL2 P60568 1/20 0.47

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
SCHEMBL19982259 1.00 YAP1 (0.82) YAP1IL2RAALBIL2
SCHEMBL21366138 0.93 YAP1 (0.83) YAP1IL2RAALBIL2
SCHEMBL21366132 0.93 YAP1 (0.83) YAP1IL2RAALBIL2
SCHEMBL19974553 0.93 YAP1 (0.75) YAP1
SCHEMBL23296224 0.93 YAP1 (0.75) YAP1
SCHEMBL19982111 0.92 YAP1 (0.81) YAP1IL2RAALBIL2
SCHEMBL19982110 0.92 YAP1 (0.81) YAP1IL2RAALBIL2
SCHEMBL19982104 0.90 YAP1 (1.00) YAP1IL2RAALBIL2
SCHEMBL19982256 0.90 YAP1 (1.00) YAP1IL2RAALBIL2
SCHEMBL21366277 0.90 YAP1 (0.83) YAP1

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
WO-2018053446-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2018-03-22 WO disclosed