SCHEMBL47377

SCHEMBL47377

CCc1nccn1CCC(=O)C(C)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
ALPG P10696 2/20 0.43
PLAA Q9Y263 1/20 0.43
ALPL P05186 1/20 0.42
KMT2A Q03164 3/20 0.41
ESR1 P03372 1/20 0.39
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA3 P07451 1/20 0.37
CA4 P22748 1/20 0.37
CA6 P23280 1/20 0.37
CA5A P35218 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
CA13 Q8N1Q1 1/20 0.37
CA14 Q9ULX7 1/20 0.37
CA5B Q9Y2D0 1/20 0.37
ALDH1A1 P00352 2/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL27886864 0.81 SMN1; SMN2 (0.58) SMN1; SMN2ALPGPLAAALPLKMT2A
SCHEMBL45931 0.80 SMN1; SMN2 (0.70) SMN1; SMN2KMT2AESR1FPR2
SCHEMBL15190292 0.80 ALPG (0.46) SMN1; SMN2ALPGPLAAALPLKMT2A
SCHEMBL47378 0.79 FPR2 (0.47) ALPGPLAAALPLKMT2AESR1
SCHEMBL8958681 0.74 ALPG (0.42) SMN1; SMN2ALPGPLAAALPLCA12
SCHEMBL2792249 0.73 TLR8 (0.46) ALPGPLAAALPLKMT2ACA12
SCHEMBL26196840 0.73 ALPG (0.48) ALPGPLAAALPLKMT2ACA12
Lactic Acid SCHEMBL15334031 0.73 FDPS (0.43) SMN1; SMN2ALPGPLAAALPLKMT2A
SCHEMBL4233920 0.73 TLR8 (0.48) ALPGPLAAALPLKMT2ACA12
SCHEMBL13587991 0.72 ALPG (0.45) SMN1; SMN2ALPGPLAAALPLCA12

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
US-8383721-B2 Polymerizable ionic liquid compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-02-26 US disclosed
US-20110288227-A1 POLYMERIZABLE IONIC LIQUID COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2011-11-24 US disclosed