SCHEMBL1078022

SCHEMBL1078022

CC(C)CCN([C@H](CO)CCCCNC(=O)N(Cc1ccccc1)Cc1ccc2c(c1)OCO2)S(=O)(=O)c1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 11/20 0.46
TAS2R14 Q9NYV8 1/20 0.44
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
GAA P10253 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL6685014 1.00 BMP1 (0.46) BMP1TAS2R14ALDH1A1SMN1; SMN2NPSR1
SCHEMBL1077690 0.94 BMP1 (0.43) BMP1ALDH1A1SMN1; SMN2NPSR1GAA
SCHEMBL1039183 0.94 BMP1 (0.43) BMP1NPSR1GAAMEN1KMT2A
SCHEMBL6679488 0.94 BMP1 (0.43) BMP1ALDH1A1SMN1; SMN2NPSR1GAA
SCHEMBL1039459 0.94 BMP1 (0.45) BMP1NPSR1GAAMEN1KMT2A
SCHEMBL6622848 0.94 BMP1 (0.45) BMP1NPSR1GAAMEN1KMT2A
SCHEMBL1076810 0.92 BMP1 (0.53) BMP1
SCHEMBL1077314 0.92 BMP1 (0.48) BMP1
SCHEMBL6620756 0.92 BMP1 (0.48) BMP1
SCHEMBL1077694 0.92 BMP1 (0.47) BMP1ALDH1A1SMN1; SMN2NPSR1MEN1

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-1480941-B1 UREA DERIVATIVES AS HIV ASPARTYL PROTEASE INHIBITORS AMBRILIA BIOPHARMA INC (CA) 2011-01-26 EP disclosed
US-6528532-B1 Benzenesulfonamide group PHARMACOR INC. (CA) 2003-03-04 US disclosed