SCHEMBL8345851

SCHEMBL8345851

CC(C)[C@H]1OC(=S)N[C@@H]1C(=O)O

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 2/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
ALOX15 P16050 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
SCHEMBL8380944 0.66 EPHX1 (0.37) MEN1KMT2A
SCHEMBL5195529 0.57
SCHEMBL30405374 0.57
SCHEMBL5193897 0.57
SCHEMBL8700899 0.57
SCHEMBL23297852 0.57
SCHEMBL691410 0.56 CYP2D6 (0.41) ALOX15
SCHEMBL2707861 0.56 CYP2D6 (0.41) ALOX15
SCHEMBL16105890 0.56 CYP2D6 (0.41) ALOX15
SCHEMBL5735389 0.56 CYP2D6 (0.41) ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5948693-A COVALENTLY BONDING SIDE CHAIN OF SELECTED AMINO ACID TO SOLID SUPPORT VIA ACID-LABILE OR PHOTO-LABILE LINKER, PROTECTING C-TERMINUS, SYNTHESIZING POLYPEPTIDE ON N-TERMINUS, DEPROTECTING C-TERMINUS AND CYCLIZING POLYPEPTIDE WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1999-09-07 US disclosed
WO-1998046247-A1 SOLID PHASE SYNTHESIS OF IMMUNOSUPPRESSIVE AGENTS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1998-10-22 WO disclosed
EP-0778847-A4 IMMUNOSTIMULATORY AGENTS WISCONSIN ALUMNI RES FOUND (US) 1998-01-07 EP disclosed
EP-0778847-A1 IMMUNOSTIMULATORY AGENTS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1997-06-18 EP disclosed
US-5639852-A ANALOGS OF CYCLOSPORIN A WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1997-06-17 US disclosed
WO-1996006857-A1 IMMUNOSTIMULATORY AGENTS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1996-03-07 WO disclosed