SCHEMBL7440992

SCHEMBL7440992

CCOC(=O)C(C)(CC(C)C)P(=O)(COS(C)(=O)=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.43
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL7440530 0.70 MMP8 (0.39) MMP8ALDH1A1MAPTKMT2A
SCHEMBL8532813 0.67 MMP8 (0.42) MMP8
SCHEMBL7046980 0.65 HSD17B10 (0.39)
SCHEMBL31674162 0.64 MMP8 (0.38) MMP8ALDH1A1KMT2A
SCHEMBL17617148 0.64 MMP8 (0.56) MMP8ALDH1A1MAPTKMT2A
SCHEMBL17617202 0.64 MMP8 (0.56) MMP8ALDH1A1MAPTKMT2A
SCHEMBL4426319 0.63 MMP8 (0.76) MMP8ALDH1A1MAPTKMT2A
SCHEMBL7857447 0.63 MMP8 (0.59) MMP8ALDH1A1MAPTKMT2A
SCHEMBL10894245 0.63 TSHR (0.39) ALDH1A1
SCHEMBL8797960 0.63 MMP8 (0.38) MMP8

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6013792-A INTERSTITIAL COLLAGENASE INHIBITOR; ANTIARTHRITIC AGENTS, ANTIOSTEOPOROSIS AGENTS SYNTEX (U.S.A.), INC. (US) 2000-01-11 US disclosed
EP-0712403-B1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX INC (US) 1997-09-10 EP disclosed
EP-0712403-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX INC (US) 1996-05-22 EP disclosed
WO-1995004735-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1995-02-16 WO disclosed