SCHEMBL65230

SCHEMBL65230

CCOC(=O)C1C(=O)CCN(C(=O)O)C1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 3/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
NPEPPS P55786 2/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
P2RX7 Q99572 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
FKBP1A P62942 2/20 0.30

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
SCHEMBL21847545 0.74 MEN1 (0.38) MAPTHSD17B10ALDH1A1TSHRLMNA
SCHEMBL67381 0.73 MAPT (0.40) MAPTHSD17B10ALDH1A1LMNANPEPPS
SCHEMBL66293 0.73 PPM1B (0.32)
SCHEMBL2350221 0.71 NFKB1 (0.38) MAPTHSD17B10ALDH1A1TSHRNPEPPS
SCHEMBL16077029 0.70 ALDH1A1 (0.35) MAPTHSD17B10ALDH1A1TSHRNPSR1
SCHEMBL30800899 0.70 FKBP1A (0.32) FKBP1A
SCHEMBL25282754 0.69 PPM1D (0.34) HSD17B10ALDH1A1LMNAFKBP1A
SCHEMBL17674517 0.69 PPM1D (0.34) HSD17B10ALDH1A1LMNAFKBP1A
SCHEMBL30742994 0.69 LMNA (0.33) HSD17B10ALDH1A1TSHRLMNAMEN1
SCHEMBL22443334 0.69 RIPK1 (0.32) FKBP1A

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
US-8129538-B1 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-06 US disclosed