SCHEMBL6988743

SCHEMBL6988743

CCCCN[SiH](c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.40
TSHR P16473 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 2/20 0.38
GAA P10253 1/20 0.38
ALOX12 P18054 1/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
NAAA Q02083 1/20 0.37
HDAC3 O15379 3/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
NCOR2 Q9Y618 1/20 0.37
CA12 O43570 1/20 0.36

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
SCHEMBL2268660 0.78 KCNN4 (0.38) TSHRSIGMAR1ALDH1A1MAPTGAA
SCHEMBL10628251 0.75 SIGMAR1 (0.53) HTTTSHRSIGMAR1ALDH1A1KDM4E
SCHEMBL2100789 0.71 GAA (0.34) HTTSIGMAR1MAPTGAAKDM4E
SCHEMBL7408511 0.71 HTT (0.37) HTTTSHRSIGMAR1BCHEACHE
SCHEMBL2100765 0.69 KCNH2 (0.37) SIGMAR1ALDH1A1MAPTNPSR1KDM4E
SCHEMBL2268688 0.68 SIGMAR1 (0.34) HTTTSHRSIGMAR1ALDH1A1MAPT
SCHEMBL114779 0.67 LTA4H (0.38) TSHRSIGMAR1
SCHEMBL417994 0.67 LTA4H (0.38) TSHRSIGMAR1NPSR1
SCHEMBL49577 0.67 ALDH1A1 (0.73) HTTBCHEALDH1A1MAPTNPSR1
Biphenyl SCHEMBL7742046 0.67 SIGMAR1 (0.59) TSHRSIGMAR1ALDH1A1HDAC3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6765089-B1 FOR USE IN THE SYNTHESIS OF PEPTIDES, OLIGOSACCHARIDES, GLYCOPEPTIDES AND GLYCOLIPIDS ALCHEMIA PTY LTD (AU) 2004-07-20 US disclosed
EP-1017683-A4 PROTECTING AND LINKING GROUPS FOR ORGANIC SYNTHESIS ALCHEMIA PTY LTD (AU) 2002-03-06 EP disclosed
EP-1017683-A1 PROTECTING AND LINKING GROUPS FOR ORGANIC SYNTHESIS Alchemia Pty. Ltd. (AU) 2000-07-12 EP disclosed
WO-1999015510-A1 PROTECTING AND LINKING GROUPS FOR ORGANIC SYNTHESIS ALCHEMIA PTY. LTD. (AU) 1999-04-01 WO disclosed