SCHEMBL1990313

SCHEMBL1990313

CC(N)(N)C(O)C(O)CO

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 2/20 0.32
USP2 O75604 1/20 0.30
SLCO1B1 Q9Y6L6 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
SCHEMBL8718053 0.84 LMNA (0.48) LMNAL3MBTL1TDP1KDM4EUSP2
SCHEMBL19419877 0.77 LMNA (0.42) LMNAL3MBTL1TDP1KDM4E
SCHEMBL6847774 0.77 LMNA (0.42) LMNAL3MBTL1TDP1KDM4E
SCHEMBL3403121 0.77 LMNA (0.42) LMNAL3MBTL1TDP1KDM4E
SCHEMBL8743382 0.74 LMNA (0.40) LMNAL3MBTL1TDP1USP2SLCO1B1
SCHEMBL8431961 0.74 LMNA (0.40) LMNAL3MBTL1TDP1KDM4E
SCHEMBL5873459 0.74 LMNA (0.40) LMNAL3MBTL1TDP1KDM4E
SCHEMBL27837830 0.74 LMNA (0.31) LMNAL3MBTL1
SCHEMBL17468058 0.72 LMNA (0.38) LMNAL3MBTL1TDP1KDM4E
SCHEMBL18285214 0.72 LMNA (0.46) LMNAL3MBTL1TDP1KDM4EUSP2

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-2512446-A1 COMPOSITION OF DEXIBUPROFEN TRANSDERMAL HYDROGEL Shasun Pharmaceuticals Limited (IN) 2012-10-24 EP disclosed
CN-102665681-A Composition of dexibuprofen transdermal hydrogel SHASUN PHARMACEUTICALS LTD 2012-09-12 CN disclosed
WO-2011073998-A1 COMPOSITION OF DEXIBUPROFEN TRANSDERMAL HYDROGEL SHASUN PHARMACEUTICALS LIMITED (IN) 2011-06-23 WO disclosed
US-20080096784-A1 Composition for Cleaning Dental Instruments and Process VOCO GMBH (DE) 2008-04-24 US disclosed