SCHEMBL19485578

SCHEMBL19485578

CC(C)(C)Cc1noc(-c2cnc(-c3ccc(C[C@H](NC(=O)c4ccc(C(C)(C)C)cc4)C(=O)NCCC(O)O)cc3)nc2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ PPARG P37231 1/20 0.40
▸ PPARD Q03181 1/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.37
▸ CTSS P25774 3/20 0.37
▸ CTSK P43235 3/20 0.37
▸ CTSB P07858 2/20 0.37
▸ S1PR4 O95977 2/20 0.37
▸ S1PR1 P21453 2/20 0.37
▸ S1PR5 Q9H228 2/20 0.37
▸ S1PR3 Q99500 1/20 0.37
▸ KIFC1 Q9BW19 1/20 0.36
▸ CTSL P07711 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ SPHK2 Q9NRA0 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ ADCY6 O43306 2/20 0.34

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
SCHEMBL16306235 0.91 GCGR (0.44) L3MBTL1PPARGPPARDPPARAHDAC6
SCHEMBL20426087 0.86 CTSL (0.42) L3MBTL1CTSSCTSKCTSBS1PR4
SCHEMBL22384196 0.85 NPC1 (0.41) L3MBTL1CTSSCTSKCTSBS1PR4
SCHEMBL16305853 0.83 SRC (0.44) L3MBTL1PPARGPPARDPPARAS1PR4
SCHEMBL22384197 0.83 MCHR1 (0.43) L3MBTL1HDAC6CTSSCTSKCTSB
SCHEMBL16306225 0.82 L3MBTL1 (0.46) L3MBTL1PPARGPPARDPPARAADCY6
SCHEMBL16305719 0.82 GCGR (0.48) L3MBTL1CTSSCTSKCTSBS1PR4
SCHEMBL16306007 0.82 L3MBTL1 (0.45) L3MBTL1PPARGPPARDPPARAADCY6
SCHEMBL16305715 0.82 L3MBTL1 (0.47) L3MBTL1PPARGPPARDPPARAHDAC6
SCHEMBL16305696 0.81 SRC (0.45) L3MBTL1PPARGPPARDPPARAADCY6

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
US-9795613-B2 GLP-1 receptor modulators CELGENE INTERNATIONAL II SÀRL (CH) 2017-10-24 — — US disclosed
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