SCHEMBL19974618

SCHEMBL19974618

COC(=O)C(Cc1ccc(O)cc1)NC(=O)CC1CCN(C(=O)O)CC1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 14/20 0.65
MDM4 O15151 1/20 0.53
MDM2 Q00987 1/20 0.53
GAA P10253 1/20 0.53
IL2RA P01589 1/20 0.52
ALB P02768 1/20 0.52
IL2 P60568 1/20 0.52
KMT2A Q03164 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51

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
SCHEMBL19974617 1.00 YAP1 (0.65) YAP1MDM4MDM2GAAIL2RA
SCHEMBL19976383 0.91 YAP1 (0.69) YAP1GAAIL2RAALBIL2
SCHEMBL19976384 0.91 YAP1 (0.69) YAP1GAAIL2RAALBIL2
SCHEMBL19982219 0.87 YAP1 (0.77) YAP1MDM4MDM2IL2RAALB
SCHEMBL19982220 0.87 YAP1 (0.77) YAP1MDM4MDM2IL2RAALB
SCHEMBL19982184 0.86 YAP1 (0.84) YAP1MDM4MDM2GAAIL2RA
SCHEMBL19982251 0.86 YAP1 (0.84) YAP1MDM4MDM2GAAIL2RA
SCHEMBL19982077 0.84 YAP1 (0.55) YAP1MDM4MDM2GAAIL2RA
SCHEMBL19982076 0.83 YAP1 (0.54) YAP1IL2RAALBIL2KMT2A
SCHEMBL19982266 0.82 YAP1 (0.79) YAP1IL2RAALBIL2KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512839-A1 YAP1 INHIBITORS THAT TARGET THE INTERACTION OF YAP1 WITH OCT4 H. Lee Moffitt Cancer Center And Research Institute, Inc. (US) 2019-07-24 EP disclosed
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