SCHEMBL22384055

SCHEMBL22384055

CC(C)CCOc1ccc(-c2cnc(-c3ccc(C[C@H](NC(=O)c4ccc(C(C)(C)C)cc4)C(=O)NCCC(=O)OC(C)(C)C)cc3)nc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ KLKB1 P03952 1/20 0.41
▸ KIFC1 Q9BW19 4/20 0.40
▸ PLG P00747 1/20 0.40
▸ GCGR P47871 3/20 0.39
▸ ADCY6 O43306 2/20 0.39
▸ ADCY3 O60266 2/20 0.39
▸ ADCY9 O60503 2/20 0.39
▸ ADCY5 O95622 2/20 0.39
▸ ADCY8 P40145 2/20 0.39
▸ ADCY7 P51828 2/20 0.39
▸ ADCY2 Q08462 2/20 0.39
▸ ADCY1 Q08828 2/20 0.39
▸ ADCY4 Q8NFM4 2/20 0.39
▸ CTSS P25774 5/20 0.38
▸ CTSK P43235 3/20 0.38
▸ CTSB P07858 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ CTSL P07711 3/20 0.37

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
SCHEMBL22384056 0.95 L3MBTL1 (0.41) L3MBTL1KLKB1KIFC1PLGGCGR
SCHEMBL16305639 0.95 L3MBTL1 (0.41) L3MBTL1KLKB1KIFC1PLGGCGR
SCHEMBL16305989 0.92 GCGR (0.47) L3MBTL1KLKB1KIFC1PLGGCGR
SCHEMBL16305638 0.88 L3MBTL1 (0.46) L3MBTL1KIFC1PLGGCGRADCY6
SCHEMBL16305939 0.88 GCGR (0.48) L3MBTL1KLKB1KIFC1PLGGCGR
SCHEMBL22384200 0.88 CTSS (0.42) L3MBTL1KLKB1KIFC1PLGGCGR
SCHEMBL16375225 0.88 CTSS (0.42) L3MBTL1KLKB1KIFC1PLGGCGR
SCHEMBL16294773 0.87 GCGR (0.48) L3MBTL1KLKB1PLGGCGRADCY6
SCHEMBL16294771 0.87 GCGR (0.48) L3MBTL1KLKB1PLGGCGRADCY6
SCHEMBL16305641 0.85 L3MBTL1 (0.46) L3MBTL1KLKB1KIFC1PLGGCGR

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
EP-3230276-B1 GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-09-02 — — EP disclosed
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