SCHEMBL6535156

SCHEMBL6535156

CC(C)(C)N(C(=O)O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
HSD17B10 Q99714 2/20 0.43
CYP2C19 P33261 1/20 0.43
ACE P12821 9/20 0.36
REN P00797 3/20 0.36
KDM4E B2RXH2 1/20 0.36
F2 P00734 1/20 0.36
LTA4H P09960 1/20 0.36
MAPT P10636 1/20 0.36
PEPD P12955 1/20 0.36
ALOX15 P16050 1/20 0.36
PTGS1 P23219 1/20 0.36
HTR2A P28223 1/20 0.36
PTGS2 P35354 1/20 0.36
HRH1 P35367 1/20 0.36
THPO P40225 1/20 0.36
PMP22 Q01453 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
THRB P10828 1/20 0.36
ALOX12 P18054 1/20 0.36

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
SCHEMBL6560015 0.77 LMNA (0.32) LMNA
SCHEMBL3924487 0.76 ACE (0.41) LMNAHSD17B10CYP2C19ACEREN
SCHEMBL28261258 0.76 ACE (0.41) LMNAHSD17B10CYP2C19ACEREN
SCHEMBL9230240 0.72 ACE (0.40) LMNAHSD17B10CYP2C19ACEREN
SCHEMBL6558727 0.72
SCHEMBL10906984 0.71 ACE (0.41) LMNAHSD17B10CYP2C19ACEREN
SCHEMBL28267035 0.69 ACE (0.43) LMNAHSD17B10CYP2C19ACEREN
SCHEMBL3462968 0.68 HSD17B10 (0.49) LMNAHSD17B10CYP2C19ACEREN
SCHEMBL10037292 0.68 HSD17B10 (0.49) LMNAHSD17B10CYP2C19ACEREN
SCHEMBL1905956 0.68 HSD17B10 (0.49) LMNAHSD17B10CYP2C19ACEREN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1146855-A4 THERAPEUTIC DELIVERY USING COMPOUNDS SELF-ASSEMBLED INTO HIGH AXIAL RATIO MICROSTRUCTURES UNIV WASHINGTON (US) 2004-06-16 EP disclosed
EP-1146855-A1 THERAPEUTIC DELIVERY USING COMPOUNDS SELF-ASSEMBLED INTO HIGH AXIAL RATIO MICROSTRUCTURES University of Washington (US) 2001-10-24 EP disclosed
US-6180114-B1 A DEVICE-FREE METHOD BY WHICH LIGANDS, SUCH AS DRUGS, CAN BE RELEASED INTO THE BODY, PARTICULARLY IN CONTINUOUS MANNER THROUGH ASSOCIATION WITH HIGH AXIAL RATIO MICROSTRUCTURES (HARMS) UNIVERSITY OF WASHINGTON 2001-01-30 US disclosed
WO-2000037046-A1 THERAPEUTIC DELIVERY USING COMPOUNDS SELF-ASSEMBLED INTO HIGH AXIAL RATIO MICROSTRUCTURES UNIVERSITY OF WASHINGTON (US) 2000-06-29 WO disclosed
US-5851536-A Therapeutic delivery using compounds self-assembled into high axial ratio microstructures UNIVERSITY OF WASHINGTON (US) 1998-12-22 US disclosed