SCHEMBL13689237

SCHEMBL13689237

O=C(O)COCC(=O)NCCOCCOCCOCCOCCOCCNC(=O)CO

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 8/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.33
RECQL P46063 1/20 0.33
NCF1 P14598 1/20 0.33
CA2 P00918 3/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA4 P22748 2/20 0.33
CA9 Q16790 2/20 0.33
CA14 Q9ULX7 2/20 0.33
LMNA P02545 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
SCHEMBL2743010 0.93 SMN1; SMN2 (0.43) GLP1RSMN1; SMN2MEN1KMT2APOLB
SCHEMBL229364 0.89 MEN1 (0.39) GLP1RSMN1; SMN2MEN1KMT2APOLB
SCHEMBL2743011 0.87 GLP1R (0.37) GLP1RSMN1; SMN2MEN1KMT2APOLB
SCHEMBL422917 0.84 GLP1R (0.38) GLP1RSMN1; SMN2MEN1KMT2APOLB
SCHEMBL18723358 0.84 GLP1R (0.46) GLP1RSMN1; SMN2MEN1KMT2APOLB
SCHEMBL24855312 0.84 GLP1R (0.43) GLP1RSMN1; SMN2MEN1KMT2ATSHR
SCHEMBL30748711 0.84 CYP1A2 (0.42) GLP1RSMN1; SMN2MEN1KMT2ATSHR
SCHEMBL13274091 0.84 GLP1R (0.41) GLP1RSMN1; SMN2MEN1KMT2ATSHR
SCHEMBL16943973 0.84 GLP1R (0.38) GLP1RSMN1; SMN2MEN1KMT2APOLB
SCHEMBL964367 0.84 GLP1R (0.38) GLP1RSMN1; SMN2MEN1KMT2APOLB

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-2009108484-A1 SYNTHESIS OF A PEG-6 MOIETY FROM COMMERCIAL LOW-COST CHEMICALS GE HEALTHCARE LIMITED (GB) 2009-09-03 WO disclosed