SCHEMBL4654597

SCHEMBL4654597

CC(NC1C2CC3CC(C2)CC1C3)C(=O)N[C@H](CCC(N)=O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 1/20 0.39
EPHX2 P34913 2/20 0.38
KMT2A Q03164 1/20 0.36
NOD1 Q9Y239 1/20 0.36
FOLH1 Q04609 3/20 0.36
PRSS1 P07477 2/20 0.35
TMPRSS15 P98073 2/20 0.35
CA2 P00918 4/20 0.35
CA1 P00915 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BMP1 P13497 1/20 0.34
ECE1 P42892 2/20 0.34
POLB P06746 1/20 0.34
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33

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
SCHEMBL2251861 0.84 L3MBTL1 (0.38) CPB2EPHX2KMT2ACA2CA1
SCHEMBL19177556 0.76 KMT2A (0.43) KMT2ANOD1FOLH1PRSS1TMPRSS15
SCHEMBL4300867 0.74 NOD1 (0.44) KMT2ANOD1FOLH1PRSS1TMPRSS15
SCHEMBL19177222 0.74 GNPAT (0.44) KMT2ANOD1FOLH1CA2CA1
SCHEMBL27857032 0.74 KMT2A (0.47) KMT2ANOD1FOLH1PRSS1TMPRSS15
SCHEMBL15017971 0.74 GNPAT (0.44) KMT2ANOD1FOLH1CA2CA1
SCHEMBL156957 0.74 GNPAT (0.44) KMT2ANOD1FOLH1CA2CA1
SCHEMBL156956 0.74 GNPAT (0.44) KMT2ANOD1FOLH1CA2CA1
SCHEMBL15822646 0.73 KMT2A (0.48) KMT2ANOD1FOLH1PRSS1TMPRSS15
SCHEMBL15822647 0.73 KMT2A (0.48) KMT2ANOD1FOLH1PRSS1TMPRSS15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1888111-A4 MODULATION OF CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) ACTIVITY AVANT IMMUNOTHERAPEUTICS INC (US) 2008-11-19 EP disclosed
EP-1888111-A1 MODULATION OF CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) ACTIVITY Avant Immunotherapeutics, Inc. (US) 2008-02-20 EP disclosed
WO-2006133196-A1 MODULATION OF CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) ACTIVITY AVANT IMMUNOTHERAPEUTICS, INC. (US) 2006-12-14 WO disclosed
US-20060276400-A1 Modulation of cholesteryl ester transfer protein (CETP) activity AVANT IMMUNOTHERAPEUTICS, INC. 2006-12-07 US disclosed
US-7078036-B2 Modulation of cholesteryl ester transfer protein (CETP) activity AVANT IMMUNOTHERAPEUTICS, INC. (US) 2006-07-18 US disclosed
US-20040087481-A1 Modulation of cholesteryl ester transfer protein (CETP) activity CELLDEX THERAPEUTICS, INC. 2004-05-06 US disclosed
US-20030108559-A1 Modulation of cholesteryl ester transfer protein (CETP) activity CELLDEX THERAPEUTICS, INC. 2003-06-12 US disclosed
US-6555113-B1 Elevating the ratio of circulating HDL to circulating LDL by administering a peptide conjugate of a helper T cell epitope portion linked to a B cell epitope portion; decrease in development of atherosclerotic lesions AVANT IMMUNOTHERAPEUTICS, INC. 2003-04-29 US disclosed
US-6410022-B1 Modulation of cholesteryl ester transfer protein (CETP) activity AVANT IMMUNOTHERAPEUTICS, INC. 2002-06-25 US disclosed
US-20020042364-A1 Modulation of cholesteryl ester transfer protein (CETP) activity RITTERSHAUS CHARLES W (US) 2002-04-11 US disclosed
EP-1024825-A1 XENOGENEIC CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) FOR MODULATION OF CETP ACTIVITY Avant Immunotherapeutics, Inc. (US) 2000-08-09 EP disclosed
WO-1999020302-A1 XENOGENEIC CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) FOR MODULATION OF CETP ACTIVITY AVANT IMMUNOTHERAPEUTICS, INC. (US) 1999-04-29 WO disclosed