SCHEMBL13630778

SCHEMBL13630778

O=CCCCC(=O)ONC(=O)CCC=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.33
CNR2 P34972 2/20 0.33
CNR1 P21554 1/20 0.33
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.30

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
SCHEMBL13886959 0.86 CNR2 (0.47) CNR2CNR1TSHRALDH1A1LMNA
SCHEMBL15773178 0.86 ALDH1A1 (0.38) CNR2ALDH1A1LMNA
SCHEMBL17178187 0.86 ALDH1A1 (0.38) CNR2ALDH1A1LMNA
SCHEMBL18960979 0.84 CNR2 (0.49) CNR2TSHRALDH1A1LMNAMAPT
SCHEMBL24977871 0.83 ALDH1A1 (0.40) CNR2CNR1TSHRALDH1A1
SCHEMBL14304519 0.82 KDM4E (0.31) LMNA
SCHEMBL8006975 0.82 HIF1A (0.35) HIF1ACNR2CNR1TSHRALDH1A1
SCHEMBL15773142 0.82 CNR2 (0.35) CNR2ALDH1A1LMNA
SCHEMBL13299326 0.81 ALDH1A1 (0.32) CNR2TSHRALDH1A1MAPT
SCHEMBL16273736 0.78

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-2009140683-A1 LIVING COPOLYMER PROTEIN/PEPTIDE HYBRIDS FOR BIOMEDICAL APPLICATIONS RESEARCH FOUNDATION OF THE CITY UNIVERSITY OF NEW YORK (US) 2009-11-19 WO disclosed