SCHEMBL8843349

SCHEMBL8843349

COc1ccc(S(=O)(=O)N(Cc2ccccc2)NC(=O)CCO)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 2/20 0.58
TAS2R14 Q9NYV8 4/20 0.55
CXCR3 P49682 2/20 0.55
PTGES O14684 1/20 0.55
TAS2R8 Q9NYW2 1/20 0.55
LMNA P02545 3/20 0.50
ALDH1A1 P00352 3/20 0.50
MAPT P10636 1/20 0.50
NR3C1 P04150 1/20 0.50
PGR P06401 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
MMP3 P08254 1/20 0.49
MMP1 P03956 2/20 0.48
MMP9 P14780 2/20 0.48
MMP13 P45452 2/20 0.48
TSHR P16473 1/20 0.48
KEAP1 Q14145 1/20 0.48
NFE2L2 Q16236 1/20 0.48

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
SCHEMBL4797683 0.88 BMP1 (0.55) BMP1TAS2R14CXCR3PTGESTAS2R8
SCHEMBL7089288 0.87 BMP1 (0.56) BMP1TAS2R14CXCR3PTGESTAS2R8
SCHEMBL7087595 0.83 BMP1 (0.53) BMP1TAS2R14CXCR3PTGESTAS2R8
SCHEMBL7343981 0.76 BMP1 (0.77) BMP1TAS2R14CXCR3PTGESTAS2R8
SCHEMBL6321588 0.75 TAS2R14 (0.69) BMP1TAS2R14CXCR3PTGESTAS2R8
SCHEMBL6997496 0.74 BMP1 (0.89) BMP1TAS2R14CXCR3PTGESTAS2R8
SCHEMBL22265923 0.74 ALDH1A1 (0.66) BMP1TAS2R14CXCR3PTGESTAS2R8
SCHEMBL28729777 0.74 TAS2R14 (0.80) BMP1TAS2R14CXCR3PTGESTAS2R8
SCHEMBL7338644 0.74 MEP1B (0.81) BMP1TAS2R14CXCR3PTGESTAS2R8
SCHEMBL5092519 0.73 KEAP1 (0.81) BMP1TAS2R14CXCR3PTGESTAS2R8

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-5672615-A MATRIX-DEGRADING METALLOPROTEINASE INHIBITORS NOVARTIS CORPORATION (US) 1997-09-30 US disclosed