SCHEMBL8764771

SCHEMBL8764771

CCOC(=O)C(CC(C)C)(C[PH](=O)CSc1ccc2ccccc2n1)OCC

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRNP P04156 9/20 0.49
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
ALDH1A1 P00352 5/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
MAPT P10636 4/20 0.43
THRB P10828 1/20 0.39
RXFP1 Q9HBX9 6/20 0.39
KDM4E B2RXH2 2/20 0.39
NPSR1 Q6W5P4 4/20 0.38
MAPK10 P53779 2/20 0.38
RAB9A P51151 3/20 0.37
HPGD P15428 2/20 0.36
SMN1; SMN2 Q16637 4/20 0.35
LMNA P02545 3/20 0.34
NPC1 O15118 2/20 0.34
PTBP1 P26599 1/20 0.34
TDP1 Q9NUW8 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
SCHEMBL7049095 0.87 PRNP (0.49) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7051087 0.85 PRNP (0.47) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7046337 0.84 PRNP (0.46) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7050118 0.83 ALDH1A1 (0.34) PRNPKMT2AMEN1ALDH1A1MAPT
SCHEMBL7049866 0.83 PRNP (0.45) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7049701 0.82 ALDH1A1 (0.36) ALDH1A1L3MBTL1MAPTRAB9AHPGD
SCHEMBL7050190 0.81 ALDH1A1 (0.35) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL8764856 0.81 PRNP (0.53) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7050255 0.77 PRNP (0.47) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7049726 0.76 PRNP (0.50) PRNPKMT2AMEN1ALDH1A1L3MBTL1

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
EP-0793643-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1997-09-10 EP disclosed
EP-0726903-B1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX INC (US) 1997-07-16 EP disclosed
EP-0726903-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX INC (US) 1996-08-21 EP disclosed
WO-1996016027-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1996-05-30 WO disclosed
WO-1995012603-A1 MATRIX METALLOPROTEASE INHIBITORS________________________________ SYNTEX (U.S.A.) INC. (US) 1995-05-11 WO disclosed