SCHEMBL7449784

SCHEMBL7449784

CCOC(=O)C(CC(C)C)C(CSc1ccc2ccccc2n1)[PH2]=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRNP P04156 9/20 0.54
KMT2A Q03164 4/20 0.54
MEN1 O00255 2/20 0.54
ALDH1A1 P00352 6/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MAPT P10636 3/20 0.47
RXFP1 Q9HBX9 6/20 0.43
KDM4E B2RXH2 2/20 0.43
NPSR1 Q6W5P4 4/20 0.41
MAPK10 P53779 2/20 0.41
RAB9A P51151 2/20 0.40
THRB P10828 1/20 0.40
HPGD P15428 2/20 0.40
CNR2 P34972 1/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL9067053 0.87 PRNP (0.53) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL9067414 0.82 PRNP (0.48) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL8529947 0.82 CYP3A4 (0.41) KMT2AMEN1ALDH1A1L3MBTL1MAPT
SCHEMBL8530425 0.80 MTNR1A (0.41) KMT2AMEN1ALDH1A1L3MBTL1MAPT
SCHEMBL8528289 0.79 CDC25B (0.39) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL8764768 0.77 PRNP (0.51) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7050182 0.77 MAPK1 (0.37) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7049697 0.75 L3MBTL1 (0.35) KMT2AALDH1A1L3MBTL1MAPTKDM4E
SCHEMBL7049711 0.75 PRNP (0.51) PRNPKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL7049715 0.73 PRNP (0.46) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5773428-A BONE DISORDERS SYNTEX (U.S.A.) INC. (US) 1998-06-30 US disclosed
EP-0807114-A1 BRIDGED INDOLES AS MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1997-11-19 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
EP-0712403-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX INC (US) 1996-05-22 EP disclosed
WO-1995012603-A1 MATRIX METALLOPROTEASE INHIBITORS________________________________ SYNTEX (U.S.A.) INC. (US) 1995-05-11 WO disclosed
WO-1995004735-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1995-02-16 WO disclosed