SCHEMBL7765563

SCHEMBL7765563

CCNC(=O)N(CC)CCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
ALDH2 P05091 2/20 0.42
GAA P10253 2/20 0.37
LMNA P02545 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
POLB P06746 1/20 0.33
CA12 O43570 3/20 0.32
CA9 Q16790 3/20 0.32
CA1 P00915 2/20 0.32
MMP1 P03956 2/20 0.32
MMP2 P08253 2/20 0.32
MMP3 P08254 2/20 0.32
MMP8 P22894 2/20 0.32
MMP9 P14780 1/20 0.32
KMT2A Q03164 1/20 0.31
MCL1 Q07820 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRL1 P41146 1/20 0.30
CA2 P00918 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
SCHEMBL4572776 0.91 ALDH1A1 (0.40) ALDH1A1ALDH2GAAKDM4ECA12
SCHEMBL27665956 0.88 CA12 (0.38) ALDH1A1ALDH2GAALMNACA12
SCHEMBL7766497 0.85 ALDH1A1 (0.41) ALDH1A1ALDH2LMNAKDM4EGLA
SCHEMBL968823 0.84 CA12 (0.43) ALDH1A1ALDH2GAALMNACA12
SCHEMBL969221 0.84 ALDH1A1 (0.43) ALDH1A1ALDH2GAALMNAPOLB
SCHEMBL3934067 0.84 ALDH1A1 (0.43) ALDH1A1ALDH2GAALMNAPOLB
SCHEMBL11832724 0.81 ALDH1A1 (0.36) ALDH1A1ALDH2GAALMNACA12
SCHEMBL965270 0.81 CA12 (0.53) ALDH1A1ALDH2GAALMNACA12
SCHEMBL9475754 0.79 ALDH1A1 (0.41) ALDH1A1ALDH2GAALMNACA12
SCHEMBL23717178 0.78 ALDH1A1 (0.42) ALDH1A1ALDH2GAALMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001089591-A2 SURFACE-TREATED SUPERABSORBENT POLYMER PARTICLES BASF AKTIENGESELLSCHAFT (DE) 2001-11-29 WO claimed
US-9150673-B2 Process for preparing (meth)acrylic esters BASF SE (DE) 2015-10-06 US disclosed
CN-103635462-A Method for producing acrylic esters BASF SE 2014-03-12 CN disclosed
US-20130178592-A1 PROCESS FOR PREPARING (METH)ACRYLIC ESTERS BASF SE (DE) 2013-07-11 US disclosed
CN-1993316-B Catalytic methods for the production of (meth)acrylates from n-hydroxyalkylated amides BASF AG 2011-07-20 CN disclosed
CN-1993316-A Catalytic methods for the production of (meth)acrylates from n-hydroxyalkylated amides BASF AG (DE) 2007-07-04 CN disclosed