SCHEMBL3950282

SCHEMBL3950282

CC(=O)NCC(=O)N1CCCC1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 3/20 0.49
FAP Q12884 2/20 0.49
PREP P48147 1/20 0.49
TSHR P16473 1/20 0.47
ATM Q13315 1/20 0.46
PPID Q08752 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 2/20 0.42

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
SCHEMBL3943991 0.98 TSHR (0.50) DPP4FAPPREPTSHRATM
SCHEMBL17737713 0.96 DPP4 (0.49) DPP4FAPPREPTSHRATM
SCHEMBL17084546 0.85 CYP1A2 (0.46) DPP4FAPPREPRAB9ANPSR1
SCHEMBL8230809 0.83 TDP1 (0.50) DPP4FAPPREPNPSR1L3MBTL1
SCHEMBL2386717 0.82 FAP (0.41) DPP4FAPPREPTSHRPPID
SCHEMBL3316350 0.82 FAP (0.41) DPP4FAPPREPTSHRNPSR1
SCHEMBL10662926 0.82 FAP (0.41) DPP4FAPPREPNPSR1KMT2A
SCHEMBL13135936 0.82 HTT (0.52) DPP4FAPPREPTSHRRAB9A
SCHEMBL2907861 0.80 ATM (0.48) DPP4TSHRATMPPIDRAB9A
SCHEMBL8353377 0.79 TSHR (0.53) DPP4TSHRATMPPIDRAB9A

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
WO-2009019508-A1 CALCIUM ION CHANNEL MODULATORS & USES THEREOF LECTUS THERAPEUTICS LIMITED (GB) 2009-02-12 WO claimed
WO-2013033270-A2 BROMODOMAIN LIGANDS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME COFERON, INC. (US) 2013-03-07 WO disclosed