SCHEMBL22601993

SCHEMBL22601993

CCOC(=O)[C@H]1CC[C@](N)([SiH3])CN1C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 2/20 0.39
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 3/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
SRC P12931 4/20 0.31

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
SCHEMBL22602099 0.85 FKBP1A (0.39) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL28225824 0.84 FKBP1A (0.40) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL16749487 0.82 FKBP1A (0.41) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL16749275 0.82 FKBP1A (0.41) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL17924716 0.82 FKBP1A (0.41) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL16541366 0.77 PEPD (0.39) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL16800201 0.77 PEPD (0.39) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL16800190 0.77 PEPD (0.39) FKBP1AMEN1KMT2AALDH1A1TSHR
SCHEMBL22601986 0.76 MEN1 (0.44) FKBP1AMEN1KMT2ATSHRKDM4E
SCHEMBL1269177 0.76 FKBP1A (0.38) FKBP1AMEN1KMT2AALDH1A1TSHR

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-2020216766-A1 MODULATORS OF THE INTEGRATED STRESS RESPONSE PATHWAY EVOTEC INTERNATIONAL GMBH (DE) 2020-10-29 WO disclosed