SCHEMBL22384306

SCHEMBL22384306

CC(C)CCCCOc1ccc(-c2cnc(-c3ccc(C[C@H](NC(=O)c4ccc(C(C)(C)C)cc4)C(=O)NC(C)C(=O)O)cc3)nc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 1/20 0.46
▸ ITGB3 P05106 2/20 0.43
▸ ITGA2B P08514 1/20 0.43
▸ KLKB1 P03952 1/20 0.43
▸ CBX4 O00257 3/20 0.43
▸ CBX7 O95931 3/20 0.43
▸ CDYL2 Q8N8U2 3/20 0.43
▸ CBX8 Q9HC52 3/20 0.43
▸ PPARG P37231 2/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CBX6 O95503 1/20 0.39
▸ CBX2 Q14781 1/20 0.39
▸ ITGB1 P05556 3/20 0.39
▸ ITGAV P06756 1/20 0.39
▸ ITGA5 P08648 1/20 0.39
▸ GPR132 Q9UNW8 1/20 0.39
▸ ITGA4 P13612 2/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.38
▸ CTSB P07858 1/20 0.38

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
SCHEMBL16305840 1.00 RARB (0.46) RARBITGB3ITGA2BKLKB1CBX4
SCHEMBL16305736 0.98 KLKB1 (0.43) RARBITGB3ITGA2BKLKB1CBX4
SCHEMBL16305950 0.93 PPARG (0.48) RARBITGB3ITGA2BKLKB1CBX4
SCHEMBL16305949 0.93 KLKB1 (0.46) ITGB3ITGA2BKLKB1CBX4CBX7
SCHEMBL16295654 0.92 PPARG (0.50) RARBITGB3ITGA2BKLKB1CBX4
SCHEMBL16305364 0.92 PPARG (0.50) RARBITGB3ITGA2BKLKB1CBX4
SCHEMBL16306232 0.92 PPARG (0.50) RARBITGB3ITGA2BKLKB1CBX4
SCHEMBL16305360 0.92 PPARG (0.50) RARBITGB3ITGA2BKLKB1CBX4
SCHEMBL16305951 0.92 PPARG (0.50) RARBITGB3ITGA2BKLKB1CBX4
SCHEMBL16295701 0.92 PPARG (0.50) RARBITGB3ITGA2BKLKB1CBX4

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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