SCHEMBL4564723

SCHEMBL4564723

CCCCCNC(O)N1CCCC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
MAPT P10636 2/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
MAPK1 P28482 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 2/20 0.35
TSHR P16473 2/20 0.34
EPHX1 P07099 6/20 0.34
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
FPR3 P25089 1/20 0.33
FPR2 P25090 1/20 0.33
LMNA P02545 2/20 0.32
XBP1 P17861 1/20 0.32
ABCB11 O95342 1/20 0.32
EGFR P00533 1/20 0.32

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
SCHEMBL4451471 0.76 KDM4E (0.45) ALDH1A1MAPTL3MBTL1MAPK1NPSR1
SCHEMBL11496670 0.72 ALDH1A1 (0.56) ALDH1A1MAPTL3MBTL1MAPK1NPSR1
SCHEMBL3928047 0.69 L3MBTL1 (0.39) ALDH1A1MAPTL3MBTL1MAPK1NPSR1
SCHEMBL8871029 0.69 EPHX1 (0.44) ALDH1A1MAPK1NPSR1MEN1KMT2A
SCHEMBL27630557 0.69 EPHX1 (0.44) ALDH1A1MAPK1NPSR1MEN1KMT2A
SCHEMBL27520398 0.69 EPHX1 (0.44) ALDH1A1MAPK1NPSR1MEN1KMT2A
SCHEMBL8871460 0.69 EPHX1 (0.44) ALDH1A1MAPK1NPSR1MEN1KMT2A
SCHEMBL720552 0.68 EPHX1 (0.39) ALDH1A1KDM4ETSHREPHX1GNAI3
SCHEMBL719934 0.68 EPHX1 (0.39) ALDH1A1KDM4ETSHREPHX1GNAI3
SCHEMBL3926243 0.68 GPR84 (0.41) MAPTL3MBTL1MAPK1NPSR1MEN1

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-2112991-A1 NEW SYNTHONS FOR THE SYNTHESIS OF CHIRAL PEPTIDE NUCLEIC ACIDS AND METHODS FOR PREPARING THE SAME Nanodream S.r.l. Unipersonale (IT) 2009-11-04 EP disclosed
WO-2008101515-A1 NEW SYNTHONS FOR THE SYNTHESIS OF CHIRAL PEPTIDE NUCLEIC ACIDS AND METHODS FOR PREPARING THE SAME NANODREAM S.R.L. UNIPERSONALE (IT) 2008-08-28 WO disclosed