SCHEMBL22384060

SCHEMBL22384060

CC(C)(C)OC(=O)CNC(=O)C(Cc1ccc(-c2ncc(Br)cn2)cc1)NC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ CTSS P25774 9/20 0.44
▸ CTSK P43235 8/20 0.44
▸ CTSB P07858 6/20 0.42
▸ CTSL P07711 5/20 0.42
▸ MAPT P10636 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ KIFC1 Q9BW19 2/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ KLKB1 P03952 1/20 0.40
▸ PLG P00747 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
SCHEMBL16305641 0.93 L3MBTL1 (0.46) L3MBTL1CTSSCTSKCTSBCTSL
SCHEMBL22384053 0.93 L3MBTL1 (0.46) L3MBTL1CTSSCTSKCTSBCTSL
SCHEMBL15037039 0.88 MAPT (0.46) MAPTTDP1KMT2A
SCHEMBL16342898 0.88 MAPT (0.46) MAPTTDP1KMT2A
SCHEMBL16305640 0.86 TDP1 (0.43) L3MBTL1CTSSCTSKCTSBCTSL
SCHEMBL22756194 0.86 TDP1 (0.43) L3MBTL1CTSSCTSKCTSBCTSL
SCHEMBL28534838 0.86 TDP1 (0.43) L3MBTL1CTSSCTSKCTSBCTSL
SCHEMBL22384182 0.86 CTSS (0.42) L3MBTL1CTSSCTSKCTSBCTSL
SCHEMBL16294368 0.85 GCGR (0.52) L3MBTL1CTSSCTSKCTSBCTSL
SCHEMBL16294369 0.85 GCGR (0.52) L3MBTL1CTSSCTSKCTSBCTSL

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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