SCHEMBL2549911

SCHEMBL2549911

CC(NC(=O)OC(C)(C)C)c1nc2ccc(-c3ccccc3F)cc2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 6/20 0.54
TRPV1 Q8NER1 1/20 0.46
SCD O00767 4/20 0.44
HDAC6 Q9UBN7 1/20 0.44
PRCP P42785 2/20 0.42
PDE2A O00408 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FADS1 O60427 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL2504088 0.83 AAK1 (0.53) AAK1PRCPL3MBTL1TSHR
SCHEMBL2504091 0.83 AAK1 (0.53) AAK1PRCPL3MBTL1TSHR
SCHEMBL2505196 0.81 AAK1 (0.48) AAK1PRCPL3MBTL1TSHR
SCHEMBL13498185 0.81 AAK1 (0.48) AAK1PRCPL3MBTL1TSHR
SCHEMBL2505194 0.81 AAK1 (0.48) AAK1PRCPL3MBTL1TSHR
SCHEMBL8330091 0.81 TSHR (0.59) AAK1L3MBTL1TSHR
SCHEMBL6304376 0.81 TSHR (0.59) AAK1L3MBTL1TSHR
SCHEMBL22078549 0.77 PRCP (0.47) AAK1PRCP
SCHEMBL29915611 0.77 PRCP (0.47) AAK1PRCP
SCHEMBL15116772 0.76 AAK1 (0.66) AAK1TRPV1

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-2552908-A2 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2013-02-06 EP disclosed
WO-2011123751-A2 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2011-10-06 WO disclosed