SCHEMBL19369891

SCHEMBL19369891

CC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CCCCN

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 2/20 0.42
▸ GLP1R P43220 8/20 0.41
▸ PAOX Q6QHF9 4/20 0.40
▸ TSHR P16473 1/20 0.38
▸ KDM4A O75164 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ TET2 Q6N021 1/20 0.36
▸ DOHH Q9BU89 1/20 0.36
▸ CA12 O43570 2/20 0.36
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA4 P22748 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ CA14 Q9ULX7 2/20 0.36
▸ CES2 O00748 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL16307723 0.96 SLC6A5 (0.46) SLC6A5GLP1RPAOXTSHRKDM4A
SCHEMBL17029409 0.90 CA2 (0.38) GLP1RTSHRCA12CA1CA2
SCHEMBL12147645 0.90 TSHR (0.47) GLP1RTSHRCA12CA1CA2
SCHEMBL24393831 0.87 CES2 (0.39) PAOXTSHRCA12CA1CA2
SCHEMBL16426613 0.86 MEN1 (0.40) GLP1RTSHRCA12CA1CA2
SCHEMBL12655854 0.86 MEN1 (0.40) GLP1RTSHRCA12CA1CA2
SCHEMBL13035784 0.86 MEN1 (0.40) GLP1RTSHRCA12CA1CA2
SCHEMBL12850137 0.86 MEN1 (0.40) GLP1RTSHRCA12CA1CA2
SCHEMBL12673887 0.86 GLP1R (0.48) GLP1RTSHRCES2
SCHEMBL15107494 0.86 CES2 (0.54) GLP1RCES2

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-2017189342-A1 INSULIN DIMER-INCRETIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2017-11-02 — — WO disclosed
WO-2017160669-A1 INSULIN-INCRETIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2017-09-21 — — WO disclosed
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