SCHEMBL2193456

SCHEMBL2193456

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

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
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
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL4699686 0.88 TDP1 (0.35) MEN1LMNACYP3A4CYP2C9NFKB1
SCHEMBL4698289 0.85 ALDH1A1 (0.35) MEN1LMNACYP3A4CYP2C9NFKB1
SCHEMBL915632 0.84 KMT2A (0.33) MEN1LMNACYP3A4CYP2C9NFKB1
SCHEMBL2147484 0.84 KMT2A (0.31) MEN1LMNACYP3A4CYP2C9NFKB1
SCHEMBL917125 0.84 MEN1 (0.36) MEN1LMNACYP3A4CYP2C9NFKB1
SCHEMBL4698309 0.84 PRKCA (0.36) MEN1LMNACYP3A4CYP2C9NFKB1
SCHEMBL1764576 0.83 KMT2A (0.49) MEN1LMNACYP3A4CYP2C9NFKB1
SCHEMBL12972246 0.83 KMT2A (0.35) MEN1LMNACYP3A4CYP2C9NFKB1
SCHEMBL4698290 0.82 MAPT (0.35) MEN1LMNACYP3A4CYP2C9NFKB1
SCHEMBL1346331 0.82 MEN1 (0.31) MEN1LMNACYP3A4CYP2C9NFKB1

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
WO-2011091164-A1 ORAL DOSAGE FORMS HAVING A HIGH LOADING OF A TRANEXAMIC ACID PRODRUG XENOPORT, INC. (US) 2011-07-28 WO disclosed
EP-1919859-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF TRANEXAMIC ACID, METHODS OF SYNTHESIS AND USE Xenoport, Inc. (US) 2008-05-14 EP disclosed
WO-2008013860-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF ALPHA-AMINO ACIDS, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2008-01-31 WO disclosed
WO-2007002013-A2 ACYLOXYALKYL CARBAMATE PRODRUGS OF TRANEXAMIC ACID, METHODS OF SYNTHESIS AND USE XENOPORT, INC. (US) 2007-01-04 WO disclosed