SCHEMBL6899457

SCHEMBL6899457

CC(C)[Si](c1cc(Br)ccc1CO)(C(C)C)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.35
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 1/20 0.32
SLC6A3 Q01959 1/20 0.32
LMNA P02545 3/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CHEK1 O14757 1/20 0.31
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 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
SCHEMBL9031926 0.74 PTGDR2 (0.37) SLC6A2SLC6A4PTGDR2SLC6A3LMNA
SCHEMBL20562354 0.70 PTGDR2 (0.40) SLC6A2SLC6A4PTGDR2PSEN1PSEN2
SCHEMBL31393933 0.70 PTGDR2 (0.37) SLC6A2SLC6A4PTGDR2PSEN1PSEN2
SCHEMBL9033192 0.70 NPC1 (0.36) SLC6A2SLC6A4PTGDR2LMNAHTT
SCHEMBL29417721 0.69 PTGDR2 (0.48) SLC6A2SLC6A4PTGDR2SLC6A3LMNA
SCHEMBL795719 0.69 PTGDR2 (0.48) SLC6A2SLC6A4PTGDR2SLC6A3LMNA
SCHEMBL30352488 0.69 PYCR1 (0.47) SLC6A2SLC6A4PTGDR2LMNAMAPT
SCHEMBL15720088 0.69 PTGDR2 (0.44) SLC6A2SLC6A4PTGDR2SLC6A3LMNA
SCHEMBL6673 0.69 PYCR1 (0.47) SLC6A2SLC6A4PTGDR2LMNAMAPT
SCHEMBL754025 0.69 KDM4E (0.41) SLC6A2SLC6A4PTGDR2SLC6A3MAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0900241-B1 SILYL LINKER FOR SOLID PHASE ORGANIC SYNTHESIS OF ARYL-CONTAINING MOLECULES SMITHKLINE BEECHAM CORP (US) 2004-01-28 EP disclosed
EP-0900241-A4 SILYL LINKER FOR SOLID PHASE ORGANIC SYNTHESIS OF ARYL-CONTAINING MOLECULES SMITHKLINE BEECHAM CORP (US) 2002-10-09 EP disclosed
US-6127489-A Silyl linker for solid phase organic synthesis of aryl-containing molecules SMITHKLINE BEECHAM CORPORATION (US) 2000-10-03 US disclosed
EP-0900241-A1 SILYL LINKER FOR SOLID PHASE ORGANIC SYNTHESIS OF ARYL-CONTAINING MOLECULES SMITHKLINE BEECHAM CORPORATION (US) 1999-03-10 EP disclosed
WO-1997044367-A1 SILYL LINKER FOR SOLID PHASE ORGANIC SYNTHESIS OF ARYL-CONTAINING MOLECULES SMITHKLINE BEECHAM CORPORATION (US) 1997-11-27 WO disclosed