SCHEMBL2669291

SCHEMBL2669291

CNc1ccc(F)cc1C(=O)NC(CC1CCCCC1)C(=O)Nc1ncc(C)s1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ CTSL P07711 3/20 0.44
▸ USP30 Q70CQ3 3/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CTSS P25774 2/20 0.40
▸ GCK P35557 3/20 0.40
▸ PPM1D O15297 1/20 0.39
▸ F2RL1 P55085 2/20 0.39
▸ PDF Q9HBH1 1/20 0.39
▸ PYGL P06737 1/20 0.39
▸ CTSB P07858 1/20 0.38
▸ CTSK P43235 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
SCHEMBL2669154 0.90 CTSL (0.43) CTSLUSP30CTSSGCKPPM1D
SCHEMBL9072816 0.90 CTSL (0.45) CTSLUSP30CTSSGCKPPM1D
SCHEMBL2669300 0.89 CTSL (0.43) CTSLUSP30CTSSGCKPPM1D
SCHEMBL9072791 0.86 CTSL (0.41) CTSLUSP30CTSSGCKPPM1D
SCHEMBL2669250 0.86 PSEN1 (0.44) CTSLUSP30CTSSGCKPPM1D
SCHEMBL2669260 0.85 PSEN1 (0.43) SMN1; SMN2CTSLCTSSGCKCTSK
SCHEMBL2669262 0.85 PSEN1 (0.51) SMN1; SMN2CTSLCTSSF2RL1CTSK
SCHEMBL2669063 0.84 CTSL (0.47) CTSLUSP30CTSSGCKF2RL1
SCHEMBL2669256 0.84 CTSS (0.46) CTSLCTSSGCKF2RL1CTSB
SCHEMBL9072817 0.84 OGA (0.44) SMN1; SMN2CTSLCTSSGCKCTSK

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
WO-2007104034-A2 GLUCOKINASE ACTIVATORS TAKEDA SAN DIEGO, INC. (US) 2007-09-13 — — WO disclosed
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