SCHEMBL9977570

SCHEMBL9977570

CC(C)(CC/C(=C/C=O)c1ccc(F)cc1)[Si](C)(C)O

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.33
PTPN1 P18031 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
GAA P10253 2/20 0.31
POLB P06746 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
LMNA P02545 2/20 0.31
TP53 P04637 1/20 0.31
TNFRSF1A P19438 1/20 0.30
CES2 O00748 1/20 0.30
CES1 P23141 1/20 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
SCHEMBL9977545 0.82 PTGS1 (0.34) HTR7NPC1RAB9APTGS1PTGS2
SCHEMBL9977571 0.82 PTGS1 (0.34) HTR7NPC1RAB9APTGS1PTGS2
SCHEMBL9977568 0.81 PTGS1 (0.33) PTGS1PTGS2
SCHEMBL9977551 0.81 PTGS1 (0.33) PTGS1PTGS2
SCHEMBL9977594 0.79 TBXAS1 (0.37) HTR7NPC1RAB9AGAAPOLB
SCHEMBL9977598 0.79 TBXAS1 (0.37) HTR7NPC1RAB9AGAAPOLB
SCHEMBL9977572 0.78 NPC1 (0.53) HTR7PTPN1NPC1RAB9ALMNA
SCHEMBL9977573 0.77 MAPT (0.37) HTR7LMNA
SCHEMBL15417850 0.77 MAPT (0.37) HTR7LMNA
SCHEMBL9977601 0.76 CXCR1 (0.36) GAAPOLBLMNATP53

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
EP-2465847-A1 AZETIDINONE COMPOUNDS AND MEDICAL USE THEREOF Zhejiang Hisun Pharmaceutical Co. Ltd. (CN) 2012-06-20 EP disclosed