SCHEMBL8699124

SCHEMBL8699124

CC(C(=O)c1ccc(O[Si](C)(C)C(C)(C)C)cc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
POLB P06746 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
ATM Q13315 1/20 0.39
PREP P48147 4/20 0.39
LMNA P02545 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 4/20 0.37
CYP3A4 P08684 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MITF O75030 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HIF1A Q16665 1/20 0.36
ELANE P08246 2/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 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
SCHEMBL8699120 0.94 PREP (0.39) MAPTPOLBNPC1RAB9AMEN1
SCHEMBL8697435 0.85 PTGS1 (0.48) MAPTMEN1KMT2AL3MBTL1ATM
SCHEMBL12134448 0.83 LMNA (0.58) MAPTRAB9AMEN1KMT2ALMNA
SCHEMBL980653 0.81 PREP (0.42) KMT2APREPLMNAALDH1A1SMN1; SMN2
SCHEMBL10469262 0.81 PTGS2 (0.46) PREPLMNATSHRCYP1A2
SCHEMBL5280416 0.79 ELANE (0.57) PREPALDH1A1ELANE
SCHEMBL8644671 0.78 PREP (0.37) KMT2APREPLMNAALDH1A1SMN1; SMN2
SCHEMBL8379284 0.78 PREP (0.40) MEN1KMT2APREPLMNAALDH1A1
SCHEMBL9700930 0.77 PREP (0.40) KMT2AL3MBTL1ATMPREPALDH1A1
SCHEMBL4604318 0.77 MAPT (0.61) MAPTPOLBNPC1RAB9AMEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5834506-A TREATMENT OF HIV, AIDS; ANTIVIRAL ACTIVITY IMPROVED BY JUDICIOUS PLACEMENT OF POLAR SUBSTITUENTS WARNER-LAMBERT COMPANY (US) 1998-11-10 US disclosed