SCHEMBL7437225

SCHEMBL7437225

CCOC(=O)C(C)(CC(C)C)P(=O)(CSc1cccc2ccccc12)OCC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.37
ALDH1A1 P00352 4/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
THRB P10828 1/20 0.37
KMT2A Q03164 3/20 0.36
LMNA P02545 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 1/20 0.36
MMP8 P22894 1/20 0.34
CDC25B P30305 3/20 0.34
CNR2 P34972 1/20 0.33
NR1I2 O75469 1/20 0.33
CDC25A P30304 1/20 0.33
CDC25C P30307 1/20 0.33
EPHX2 P34913 1/20 0.33
MAPT P10636 3/20 0.32
PRNP P04156 1/20 0.32
MAPK1 P28482 1/20 0.32
CASP1 P29466 1/20 0.32
CASP3 P42574 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
SCHEMBL7438535 0.84 EPHX2 (0.37) ALDH1A1MMP8CNR2EPHX2MAPT
SCHEMBL7440530 0.83 MMP8 (0.39) HPGDALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL7049724 0.80 PRNP (0.50) HPGDALDH1A1L3MBTL1THRBKMT2A
SCHEMBL8173445 0.76 ALDH1A1 (0.39) HPGDALDH1A1KMT2ALMNAKDM4E
SCHEMBL8528294 0.74 ALDH1A1 (0.37) HPGDALDH1A1KMT2ALMNAKDM4E
SCHEMBL7050180 0.73 HSD17B10 (0.43) HPGDALDH1A1L3MBTL1THRBKMT2A
SCHEMBL7050190 0.71 ALDH1A1 (0.35) HPGDALDH1A1L3MBTL1KMT2ALMNA
SCHEMBL7244415 0.69 POLB (0.38) HPGDALDH1A1L3MBTL1THRBKMT2A
SCHEMBL7051256 0.69 PPARG (0.43) HPGDALDH1A1L3MBTL1THRBKMT2A
SCHEMBL7052124 0.67 EPHX2 (0.34) HPGDALDH1A1L3MBTL1THRBKMT2A

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 5 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
WO-1996023791-A1 BRIDGED INDOLES AS MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1996-08-08 WO 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