SCHEMBL25937688

SCHEMBL25937688

CC(C)(C)OC(=O)NCC(=O)N1CCCOc2cc(F)c(F)cc21

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
KCNQ2 O43526 1/20 0.36
CTSL P07711 1/20 0.35
AGTR2 P50052 1/20 0.35
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34
EGFR P00533 2/20 0.34
BRD4 O60885 1/20 0.34
MMP1 P03956 1/20 0.34
MMP9 P14780 1/20 0.34
MMP13 P45452 1/20 0.34
RORC P51449 3/20 0.33
INSR P06213 1/20 0.33
MET P08581 1/20 0.33

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
SCHEMBL25937565 0.89 KCNQ2 (0.40) SIGMAR1MEN1ALDH1A1KMT2AKCNQ2
SCHEMBL25937545 0.89 KCNQ2 (0.46) SIGMAR1MEN1ALDH1A1TSHRKMT2A
SCHEMBL30557580 0.89 KCNQ2 (0.46) SIGMAR1MEN1ALDH1A1TSHRKMT2A
SCHEMBL25937866 0.85 TP53 (0.40) SIGMAR1EGFRRORC
SCHEMBL25937457 0.83 GRM7 (0.47) SIGMAR1L3MBTL1CTSL
SCHEMBL25430814 0.83 MAPT (0.39) MEN1KMT2AKCNQ2AGTR2EGFR
SCHEMBL25937580 0.82 SIGMAR1 (0.40) SIGMAR1MEN1ALDH1A1TSHRKMT2A
SCHEMBL25937403 0.82 KCNQ2 (0.41) SIGMAR1MEN1ALDH1A1TSHRKMT2A
SCHEMBL25937779 0.77 KDR (0.43) SIGMAR1MEN1KMT2AMMP1MMP9
SCHEMBL25937424 0.76 NOTUM (0.53) SIGMAR1ALDH1A1L3MBTL1

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
WO-2023144793-A1 POL THETA INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-08-03 WO disclosed
WO-2023144793-A1 POL THETA INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-08-03 WO disclosed