SCHEMBL13729624

SCHEMBL13729624

CC(C)(C)CCC(=O)OCC1CCC(COC(=O)CCC(C)(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
ALDH1A1 P00352 3/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
CACNA1H O95180 1/20 0.32
LPAR1 Q92633 2/20 0.31
LPAR3 Q9UBY5 2/20 0.31
HPGD P15428 2/20 0.31
RIPK1 Q13546 1/20 0.30
SLC1A3 P43003 2/20 0.30
SLC1A2 P43004 2/20 0.30
SLC1A1 P43005 2/20 0.30
ENPP2 Q13822 2/20 0.30

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
SCHEMBL13345753 0.91 LMNA (0.62) LMNAPOLBMEN1MAPTKMT2A
SCHEMBL27469061 0.81 LMNA (0.67) LMNAPOLBMAPTALDH1A1LPAR1
SCHEMBL19942153 0.80 LMNA (0.41) LMNAPOLBMEN1MAPTKMT2A
SCHEMBL10074419 0.80 DNM1 (0.36) LMNA
SCHEMBL19941929 0.80 LMNA (0.34) LMNA
SCHEMBL19335250 0.79 LMNA (0.41) LMNA
SCHEMBL28397505 0.78 ALDH1A1 (0.47) LMNAPOLBALDH1A1
SCHEMBL9362289 0.78 LMNA (0.46) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL420322 0.78 LMNA (0.53) LMNAPOLBALDH1A1LPAR1LPAR3
SCHEMBL8335902 0.78 LMNA (0.53) LMNAPOLBALDH1A1LPAR1LPAR3

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-1401918-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING BIODEGRADABLE POLY(BETA-AMINO ESTERS) MASSACHUSETTS INST TECHNOLOGY (US) 2018-03-07 EP disclosed
WO-2009097349-A1 THERAPEUTIC COMPOSITIONS SHIRE HUMAN GENETIC THERAPIES, INC. (US) 2009-08-06 WO disclosed
WO-2008011561-A2 END-MODIFIED POLY(BETA-AMINO ESTERS) AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2008-01-24 WO disclosed
WO-2007143659-A2 CROSSLINKED, DEGRADABLE POLYMERS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2007-12-13 WO disclosed