SCHEMBL1076810

SCHEMBL1076810

COc1ccc(CN(Cc2ccc3c(c2)OCO3)C(=O)NCCCC[C@@H](CO)N(CCC(C)C)S(=O)(=O)c2ccc(N)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 19/20 0.53
MMP1 P03956 1/20 0.45
MMP8 P22894 1/20 0.45
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL1077314 0.94 BMP1 (0.48) BMP1
SCHEMBL6620756 0.94 BMP1 (0.48) BMP1
SCHEMBL1076035 0.93 BMP1 (0.51) BMP1MMP1MMP8
SCHEMBL6636209 0.93 BMP1 (0.51) BMP1MMP1MMP8
SCHEMBL6685014 0.92 BMP1 (0.46) BMP1
SCHEMBL1078022 0.92 BMP1 (0.46) BMP1
SCHEMBL1077866 0.92 BMP1 (0.50) BMP1MMP1MMP8
SCHEMBL1077690 0.92 BMP1 (0.43) BMP1
SCHEMBL1039183 0.92 BMP1 (0.43) BMP1
SCHEMBL6679488 0.92 BMP1 (0.43) BMP1

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
EP-1480941-B1 UREA DERIVATIVES AS HIV ASPARTYL PROTEASE INHIBITORS AMBRILIA BIOPHARMA INC (CA) 2011-01-26 EP disclosed
EP-1480941-A2 UREA DERIVATIVES AS HIV ASPARTYL PROTEASE INHIBITORS Procyon Biopharma Inc. (CA) 2004-12-01 EP disclosed
WO-2003074467-A2 UREA DERIVATIVES AS HIV ASPARTYL PROTEASE INHIBITORS PROCYON BIOPHARMA INC. (CA) 2003-09-12 WO disclosed
US-6528532-B1 Benzenesulfonamide group PHARMACOR INC. (CA) 2003-03-04 US disclosed