SCHEMBL8825865

SCHEMBL8825865

Cc1ccc(SC(C)(C)O[PH](=O)O)cc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.34
MAPT P10636 4/20 0.33
MLYCD O95822 1/20 0.32
DNMT1 P26358 1/20 0.32
ALDH1A1 P00352 3/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
MEN1 O00255 1/20 0.30
GAA P10253 1/20 0.30
TSHR P16473 1/20 0.30
NPC1 O15118 1/20 0.30
NFKB1 P19838 1/20 0.30
RAB9A P51151 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8825860 0.85 DNMT1 (0.33) HPGDMAPTMLYCDDNMT1ALDH1A1
SCHEMBL8826071 0.84 MAPT (0.35) MAPTKMT2ALMNAHTTMEN1
SCHEMBL8825920 0.84 ALDH1A1 (0.32) HPGDMAPTALDH1A1KMT2AMEN1
SCHEMBL8825870 0.83 PTGIR (0.39) HPGDMAPTALDH1A1LMNANPC1
SCHEMBL8826142 0.79 MAPT (0.35) HPGDMAPTMLYCDALDH1A1KMT2A
SCHEMBL11152924 0.79 MEN1 (0.43) HPGDMAPTALDH1A1KMT2ALMNA
SCHEMBL8826056 0.78 HPGD (0.35) HPGDMAPTALDH1A1KMT2ALMNA
SCHEMBL8826171 0.76 KIF11 (0.34) HPGDMAPTMLYCDALDH1A1KMT2A
SCHEMBL8826138 0.70 MAPT (0.33) HPGDMAPTDNMT1ALDH1A1KMT2A
SCHEMBL8826068 0.69 MAPT (0.35) MAPTALDH1A1KMT2ALMNAHTT

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-5591881-A DEGRADING TRIALKYLSILYL PROTECTED-THREONINE WITH NINHYDRIN; PERFORMING HONOR-WORDSWORTH-EMONS REACTION CHOONGWAE PHARMACEUTICAL CO., LTD. (KR) 1997-01-07 US claimed
US-5591881-A DEGRADING TRIALKYLSILYL PROTECTED-THREONINE WITH NINHYDRIN; PERFORMING HONOR-WORDSWORTH-EMONS REACTION CHOONGWAE PHARMACEUTICAL CO., LTD. (KR) 1997-01-07 US disclosed