SCHEMBL22384176

SCHEMBL22384176

CCCCCCCOc1ccc(-c2cnc(-c3ccc(CC(NC(=O)c4ccc(C(C)(C)C)cc4)C(=O)NCC(=O)OC(C)(C)C)cc3)nc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PLG P00747 2/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ KLKB1 P03952 1/20 0.43
▸ PPARG P37231 3/20 0.43
▸ PPARA Q07869 1/20 0.42
▸ HRH2 P25021 2/20 0.41
▸ HRH1 P35367 2/20 0.41
▸ ITGB1 P05556 2/20 0.41
▸ ITGA4 P13612 2/20 0.41
▸ ITGB3 P05106 2/20 0.40
▸ ITGA2B P08514 2/20 0.40
▸ RARB P10826 3/20 0.39
▸ GCGR P47871 1/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ PRSS2 P07478 1/20 0.39
▸ PRSS3 P35030 1/20 0.39
▸ CTSB P07858 1/20 0.39
▸ CTSS P25774 1/20 0.39
▸ CTSK P43235 1/20 0.39

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
SCHEMBL15019649 0.92 PLG (0.49) PLGL3MBTL1KLKB1PPARGPPARA
SCHEMBL15019646 0.92 PLG (0.49) PLGL3MBTL1KLKB1PPARGPPARA
SCHEMBL15037417 0.92 PLG (0.49) PLGL3MBTL1KLKB1PPARGPPARA
SCHEMBL15037348 0.92 PLG (0.49) PLGL3MBTL1KLKB1PPARGPPARA
SCHEMBL15037414 0.92 PLG (0.51) PLGL3MBTL1KLKB1PPARGPPARA
SCHEMBL16306210 0.89 PLG (0.47) PLGL3MBTL1KLKB1PPARGPPARA
SCHEMBL19807191 0.89 PLG (0.49) PLGL3MBTL1KLKB1PPARGPPARA
SCHEMBL19807189 0.89 PLG (0.49) PLGL3MBTL1KLKB1PPARGPPARA
SCHEMBL17834391 0.89 PLG (0.47) PLGL3MBTL1KLKB1PPARGPPARA
SCHEMBL16295907 0.89 PPARG (0.45) PLGL3MBTL1KLKB1PPARGPPARA

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
EP-3008056-B1 NOVEL GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-12-09 — — EP disclosed
EP-3230276-B1 GLP-1 RECEPTOR MODULATORS CELGENE INT II SARL (CH) 2020-09-02 — — EP disclosed
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