SCHEMBL4751064

SCHEMBL4751064

O=C1CNC(=O)N1CCCCO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
ALDH1A1 P00352 5/20 0.43
KMT2A Q03164 3/20 0.43
PABPC1 P11940 2/20 0.43
HTT P42858 2/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 1/20 0.43
RGS12 O14924 1/20 0.43
NPC1 O15118 1/20 0.43
RECQL P46063 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GSK3A P49840 1/20 0.42
GSK3B P49841 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.39
QPCT Q16769 1/20 0.36
HSD17B10 Q99714 2/20 0.36
USP2 O75604 1/20 0.36
MAPK1 P28482 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
SCHEMBL1401795 0.94 TSHR (0.52) TSHRALDH1A1KMT2APABPC1HTT
SCHEMBL1969772 0.85 TSHR (0.55) TSHRALDH1A1KMT2AKDM4ELMNA
SCHEMBL11582516 0.83 QPCT (0.54) TSHRALDH1A1KMT2APABPC1HTT
SCHEMBL2991298 0.80 MGLL (0.47) TSHRALDH1A1GSK3AGSK3B
SCHEMBL14761839 0.80 GSK3A (0.46) TSHRALDH1A1KMT2ALMNAMEN1
SCHEMBL10976405 0.80 TSHR (0.46) TSHRALDH1A1KMT2AHTTLMNA
SCHEMBL9805873 0.78 MGLL (0.50) TSHRGSK3AGSK3B
SCHEMBL9805934 0.78 MGLL (0.50) TSHRGSK3AGSK3B
SCHEMBL9805920 0.78 MGLL (0.50) TSHRGSK3AGSK3B
SCHEMBL9805904 0.78 MGLL (0.50) TSHRGSK3AGSK3B

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008136841-A1 POLY(CARBONATE-CO-UREA) COPOLYMERS AND MELT TRANSESTERIFICATION METHOD OF PREPARING THESE COPOLYMERS SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2008-11-13 WO disclosed