SCHEMBL8530708

SCHEMBL8530708

CCOC(=O)CCC(C)CC[PH](=O)COS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.37
KMT2A Q03164 4/20 0.37
LMNA P02545 3/20 0.37
POLB P06746 3/20 0.36
MAPT P10636 1/20 0.36
GAA P10253 3/20 0.35
MAPK1 P28482 1/20 0.35
STAT3 P40763 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL8532811 0.81 L3MBTL1 (0.35) KMT2APOLBGAA
SCHEMBL9067915 0.79 LMNA (0.39) ALDH1A1KMT2ALMNAGAASTAT3
SCHEMBL10584998 0.74 ALDH1A1 (0.47) ALDH1A1KMT2ALMNAPOLBMAPT
SCHEMBL8530713 0.73 KMT2A (0.39) ALDH1A1KMT2ALMNAGAASTAT3
SCHEMBL8528852 0.72 L3MBTL1 (0.44) ALDH1A1KMT2ALMNAPOLBGAA
SCHEMBL22660135 0.72 L3MBTL1 (0.52) ALDH1A1KMT2ALMNAPOLBMAPT
SCHEMBL1995195 0.71 GAA (0.54) ALDH1A1KMT2ALMNAPOLBMAPT
SCHEMBL17941037 0.71 L3MBTL1 (0.48) ALDH1A1KMT2ALMNAPOLBMAPT
SCHEMBL8932889 0.70 ALDH1A1 (0.38) ALDH1A1KMT2ALMNAPOLBMAPT
SCHEMBL17941005 0.70 ALDH1A1 (0.43) ALDH1A1KMT2ALMNAPOLBMAPT

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 2 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