SCHEMBL2669306

SCHEMBL2669306

CNc1ccc(OC)cc1C(=O)NC(CC1CCCCC1)C(=O)Nc1ccc(Cl)cn1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 7/20 0.46
▸ KCNH2 Q12809 4/20 0.46
▸ F2 P00734 2/20 0.46
▸ CTSS P25774 8/20 0.44
▸ CTSL P07711 6/20 0.44
▸ CTSK P43235 5/20 0.44
▸ GCK P35557 1/20 0.43
▸ PYGL P06737 1/20 0.43
▸ F9 P00740 1/20 0.42
▸ PRSS1 P07477 1/20 0.42
▸ PRSS2 P07478 1/20 0.42
▸ F7 P08709 1/20 0.42
▸ PRSS3 P35030 1/20 0.42
▸ MCHR1 Q99705 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL2669261 0.88 F10 (0.45) F10CTSSCTSLGCKPYGL
SCHEMBL2669063 0.81 CTSL (0.47) CTSSCTSLCTSKGCKPYGL
SCHEMBL2669288 0.76 GCK (0.53) KCNH2GCK
SCHEMBL2669228 0.75 CTSL (0.46) CTSSCTSLCTSKGCKPYGL
SCHEMBL2520055 0.71 GCK (0.60) GCK
SCHEMBL2669248 0.71 GCK (0.41) CTSSCTSLCTSKGCK
SCHEMBL2669291 0.70 SMN1; SMN2 (0.45) CTSSCTSLCTSKGCKPYGL
SCHEMBL2669154 0.69 CTSL (0.43) CTSSCTSLCTSKGCK
SCHEMBL9072816 0.69 CTSL (0.45) CTSSCTSLCTSKGCKPYGL
SCHEMBL2434887 0.69 F10 (0.75) F10KCNH2F2

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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