SCHEMBL19974550

SCHEMBL19974550

CC(C)(C)C(=O)N1CCC(CC(=O)N[C@@H](Cc2ccc(OCc3ccccc3)cc2)C(=O)O)CC1

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 17/20 0.81
PPARG P37231 1/20 0.54
GPR34 Q9UPC5 1/20 0.53
POLB P06746 1/20 0.52

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
SCHEMBL19982227 0.93 YAP1 (0.81) YAP1PPARG
SCHEMBL19974606 0.92 YAP1 (0.77) YAP1PPARGGPR34
SCHEMBL19975559 0.90 YAP1 (0.79) YAP1PPARGGPR34POLB
SCHEMBL23296230 0.89 YAP1 (1.00) YAP1
SCHEMBL19982075 0.89 YAP1 (1.00) YAP1
SCHEMBL19974549 0.87 YAP1 (0.85) YAP1GPR34POLB
SCHEMBL22929160 0.87 YAP1 (0.85) YAP1GPR34POLB
SCHEMBL23296240 0.87 YAP1 (0.85) YAP1GPR34POLB
SCHEMBL22929167 0.86 YAP1 (0.79) YAP1
SCHEMBL23296225 0.85 YAP1 (1.00) YAP1GPR34POLB

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