SCHEMBL19982251

SCHEMBL19982251

COC(=O)C(Cc1ccc(O)cc1)NC(=O)CC1CCN(C(=O)CCc2ccccc2)CC1

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
YAP1 P46937 16/20 0.84
GAA P10253 1/20 0.53
MDM4 O15151 1/20 0.51
MDM2 Q00987 1/20 0.51
IL2RA P01589 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
SCHEMBL19982184 1.00 YAP1 (0.84) YAP1GAAMDM4MDM2IL2RA
SCHEMBL19982192 0.92 YAP1 (0.85) YAP1GAAIL2RA
SCHEMBL19982193 0.92 YAP1 (0.85) YAP1GAAIL2RA
SCHEMBL24043545 0.91 YAP1 (1.00) YAP1GAAIL2RA
SCHEMBL19982141 0.91 YAP1 (1.00) YAP1GAAIL2RA
SCHEMBL19982102 0.91 YAP1 (1.00) YAP1GAAIL2RA
SCHEMBL19982111 0.89 YAP1 (0.81) YAP1IL2RA
SCHEMBL19982110 0.89 YAP1 (0.81) YAP1IL2RA
SCHEMBL30117577 0.88 YAP1 (0.79) YAP1IL2RA
SCHEMBL19982266 0.88 YAP1 (0.79) YAP1IL2RA

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