SCHEMBL4439232

SCHEMBL4439232

CC(C)(C)OC(=O)N(c1cccc(F)c1N)C1CCNCC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 12/20 0.36
SLC6A3 Q01959 8/20 0.36
SLC6A4 P31645 12/20 0.36
TACR1 P25103 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MBTPS1 Q14703 1/20 0.33
SSTR4 P31391 1/20 0.33
WNT1 P04628 1/20 0.33
DYRK1A Q13627 1/20 0.33

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
SCHEMBL4436886 0.86 SLC6A2 (0.35) SLC6A2SLC6A3SLC6A4TACR1MEN1
SCHEMBL4051628 0.85 SLC6A2 (0.38) SLC6A2SLC6A3SLC6A4TACR1MEN1
SCHEMBL5214565 0.83 SLC6A2 (0.37) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL8437522 0.80 SLC6A2 (0.38) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL4444981 0.77 SLC6A4 (0.40) SLC6A2SLC6A3SLC6A4TACR1MEN1
SCHEMBL20141115 0.77 SLC6A2 (0.48) SLC6A2SLC6A3SLC6A4TACR1MEN1
SCHEMBL20141529 0.76 SLC6A2 (0.39) SLC6A2SLC6A3SLC6A4MEN1KMT2A
SCHEMBL27799887 0.76 SLC6A4 (0.39) SLC6A2SLC6A3SLC6A4SSTR4
SCHEMBL4434907 0.76 TACR1 (0.40) SLC6A2SLC6A3SLC6A4TACR1
SCHEMBL7399910 0.76 SLC6A2 (0.42) SLC6A2SLC6A3SLC6A4

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-2132177-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE Novartis Ag (CH) 2009-12-16 EP disclosed
WO-2008106692-A1 PIM KINASE INHIBITORS AND METHODS OF THEIR USE NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-09-04 WO disclosed