SCHEMBL4699686

SCHEMBL4699686

CC(=O)OCC(C)COC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
NFKB1 P19838 1/20 0.35
PTGS1 P23219 1/20 0.35
APEX1 P27695 1/20 0.35
THPO P40225 1/20 0.35
PMP22 Q01453 1/20 0.35
KMT2A Q03164 1/20 0.35
MGLL Q99685 1/20 0.32
GLA P06280 1/20 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
SCHEMBL2193456 0.88 MEN1 (0.35) TDP1MEN1LMNACYP3A4CYP2C9
SCHEMBL4698289 0.85 ALDH1A1 (0.35) TDP1MEN1LMNACYP3A4CYP2C9
SCHEMBL917125 0.84 MEN1 (0.36) TDP1MEN1LMNACYP3A4CYP2C9
SCHEMBL4698309 0.84 PRKCA (0.36) TDP1MEN1LMNACYP3A4CYP2C9
SCHEMBL1764576 0.83 KMT2A (0.49) TDP1MEN1LMNACYP3A4CYP2C9
SCHEMBL12972246 0.83 KMT2A (0.35) TDP1MEN1LMNACYP3A4CYP2C9
SCHEMBL21814412 0.83 TDP1 (0.35) TDP1MEN1LMNACYP3A4CYP2C9
SCHEMBL4698290 0.82 MAPT (0.35) TDP1MEN1LMNACYP3A4CYP2C9
SCHEMBL4701760 0.80 MAPT (0.42) TDP1MEN1LMNACYP3A4KMT2A
SCHEMBL15218253 0.80 ALDH1A1 (0.38) LMNAGLA

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-1919859-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF TRANEXAMIC ACID, METHODS OF SYNTHESIS AND USE Xenoport, Inc. (US) 2008-05-14 EP disclosed
WO-2007002013-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF TRANEXAMIC ACID, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2007-01-04 WO disclosed