SCHEMBL8764852

SCHEMBL8764852

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

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRNP P04156 9/20 0.57
KMT2A Q03164 4/20 0.57
MEN1 O00255 2/20 0.57
ALDH1A1 P00352 4/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 4/20 0.43
RXFP1 Q9HBX9 6/20 0.42
NPSR1 Q6W5P4 4/20 0.42
MAPK10 P53779 2/20 0.42
THRB P10828 1/20 0.41
KDM4E B2RXH2 3/20 0.41
CYSLTR2 Q9NS75 3/20 0.41
CYSLTR1 Q9Y271 3/20 0.41
POLB P06746 1/20 0.39
RAB9A P51151 2/20 0.39
HPGD P15428 1/20 0.38
NPC1 O15118 1/20 0.37

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
SCHEMBL8529950 0.82 PRNP (0.40) PRNPKMT2AMEN1ALDH1A1MAPT
SCHEMBL8530427 0.81 ALDH1A1 (0.39) PRNPKMT2AALDH1A1L3MBTL1MAPT
SCHEMBL8763147 0.80 PRNP (0.49) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL8528291 0.80 ALDH1A1 (0.39) PRNPKMT2AMEN1ALDH1A1MAPT
SCHEMBL7449789 0.78 PRNP (0.57) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL9067054 0.76 PRNP (0.57) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL9067056 0.73 PRNP (0.53) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL9067417 0.72 KMT2A (0.53) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7053042 0.72 PRNP (0.52) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL8764771 0.72 PRNP (0.49) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-1995012603-A1 MATRIX METALLOPROTEASE INHIBITORS________________________________ SYNTEX (U.S.A.) INC. (US) 1995-05-11 WO disclosed