SCHEMBL5129073

SCHEMBL5129073

Cc1cc(C)cc(C2CCNC(=O)O2)c1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
MAOA P21397 1/20 0.41
SLC6A2 P23975 1/20 0.41
HSD11B1 P28845 2/20 0.31
HTR2C P28335 2/20 0.31

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
SCHEMBL4319758 1.00 LMNA (0.41) LMNAMAOASLC6A2HSD11B1HTR2C
SCHEMBL28957039 0.84 HTR2C (0.47) HSD11B1HTR2C
SCHEMBL29698141 0.84 HTR2C (0.47) HSD11B1HTR2C
SCHEMBL28957041 0.84 HTR2C (0.47) HSD11B1HTR2C
SCHEMBL14521456 0.75 MAOB (0.42) MAOAHSD11B1
SCHEMBL1705219 0.75 MAOB (0.42) MAOAHSD11B1
SCHEMBL13950143 0.75 MAOB (0.42) MAOAHSD11B1
SCHEMBL28730831 0.73 CA1 (0.42) LMNAMAOASLC6A2HSD11B1
SCHEMBL28730830 0.73 CA1 (0.42) LMNAMAOASLC6A2HSD11B1
SCHEMBL3650411 0.72 DDB1 (0.41) LMNASLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1973546-A2 CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITORS Merck & Co., Inc. (US) 2008-10-01 EP disclosed
WO-2007081570-A2 CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITORS MERCK & CO., INC. (US) 2007-07-19 WO disclosed