SCHEMBL11567616

SCHEMBL11567616

CCN(CCC(C)C)C(=O)n1cnc(S(=O)(=O)N2CCCCC2)n1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.37
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
CNR2 P34972 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 3/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HPGD P15428 1/20 0.34
GAA P10253 1/20 0.33

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
SCHEMBL11559102 0.90 ALDH1A1 (0.41) DPP4MAPTNPSR1LMNAHTT
SCHEMBL11566923 0.88 KMT2A (0.42) DPP4MAPTNPSR1LMNAHTT
SCHEMBL11559316 0.88 TSHR (0.40) DPP4MAPTNPSR1LMNAHTT
SCHEMBL11565457 0.87 TSHR (0.39) DPP4MAPTNPSR1LMNAHTT
SCHEMBL11559345 0.82 DPP4 (0.37) DPP4MAPTNPSR1LMNAHTT
SCHEMBL11562219 0.82 DPP4 (0.53) DPP4MAPTNPSR1LMNAHTT
SCHEMBL11566458 0.81 DPP4 (0.53) DPP4MAPTNPSR1LMNAHTT
SCHEMBL11556816 0.81 DPP4 (0.39) DPP4MAPTNPSR1HTTSMN1; SMN2
SCHEMBL11559837 0.80 DPP4 (0.41) DPP4MAPTNPSR1LMNASMN1; SMN2
SCHEMBL11563596 0.80 DPP4 (0.50) DPP4MAPTNPSR1LMNAHTT

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-4148626-A Herbicidal agents THE BOOTS COMPANY LIMITED (GB) 1979-04-10 US disclosed