SCHEMBL8629669

SCHEMBL8629669

Cc1ccc(S(=O)(=O)N(CC(C)C)CC(O)CN)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 1/20 0.55
MAPT P10636 3/20 0.47
HTT P42858 3/20 0.47
NPSR1 Q6W5P4 1/20 0.47
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
BACE1 P56817 2/20 0.45
GLA P06280 1/20 0.44
MMP3 P08254 4/20 0.44
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP13 P45452 1/20 0.43
MMP14 P50281 1/20 0.43
ADAM17 P78536 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPK1 P28482 1/20 0.43
PSEN1 P49768 2/20 0.43

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
SCHEMBL12215061 0.87 MAPT (0.48) TAS2R14MAPTHTTNPSR1KDM4E
SCHEMBL28211577 0.86 TAS2R14 (0.65) TAS2R14MAPTNPSR1GLAMMP3
SCHEMBL7641340 0.85 MMP1 (0.57) TAS2R14BACE1MMP3MMP1MMP8
SCHEMBL5190476 0.78 TAS2R14 (0.63) TAS2R14GLAMMP3MMP1MMP2
SCHEMBL9187490 0.77 GLA (0.53) TAS2R14MAPTHTTLMNAGLA
SCHEMBL6954421 0.76 TAS2R14 (0.53) TAS2R14GLAMMP3KMT2ARORC
SCHEMBL16727690 0.75 SPPL2A (0.73) TAS2R14LMNAPSEN1PSEN2APH1B
SCHEMBL7347286 0.74 MMP3 (0.76) TAS2R14MMP3MMP1MMP2MMP9
SCHEMBL8896462 0.74 GLA (0.50) TAS2R14MAPTHTTNPSR1KDM4E
SCHEMBL23129729 0.74 TAS2R14 (0.54) TAS2R14LMNAMMP3MMP1MMP2

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-5811462-A (BICYCLO(2.2.1)HEPT-5'-EN-2'-YL-CARBONYL)AMINO-3-HYDROXY DERIVATIVES MERCK & CO., INC. (US) 1998-09-22 US disclosed