SCHEMBL28874599

SCHEMBL28874599

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
HTT P42858 3/20 0.36
NPSR1 Q6W5P4 3/20 0.36
MAPT P10636 3/20 0.36
KMT2A Q03164 3/20 0.36
XBP1 P17861 1/20 0.36
PAX8 Q06710 1/20 0.36
ALDH1A1 P00352 9/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
TDP1 Q9NUW8 4/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
ELANE P08246 1/20 0.33
IKBKB O14920 1/20 0.33
NPC1 O15118 1/20 0.32
MAPK1 P28482 1/20 0.32
STAT3 P40763 1/20 0.32
STAT1 P42224 1/20 0.32

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
SCHEMBL28890782 0.83 LMNA (0.39) LMNAHTTNPSR1MAPTKMT2A
SCHEMBL6884399 0.83 LMNA (0.39) LMNAHTTNPSR1MAPTKMT2A
SCHEMBL1719096 0.83 ELANE (0.45) LMNAHTTNPSR1MAPTKMT2A
SCHEMBL475950 0.82 LMNA (0.47) LMNAHTTNPSR1MAPTKMT2A
SCHEMBL475949 0.81 ALDH1A1 (0.37) LMNAHTTNPSR1KMT2AALDH1A1
P-Xylene SCHEMBL10841401 0.74 ALDH1A1 (0.68) LMNAMAPTKMT2AALDH1A1CES2
SCHEMBL706767 0.73 HPGD (0.38) LMNAMAPTALDH1A1RAB9APKM
SCHEMBL10706499 0.72 SLC22A6 (0.31) HTTKMT2ARAB9AMEN1
P-Xylene SCHEMBL11360520 0.71 THRB (0.57) LMNAHTTKMT2AALDH1A1CES2
SCHEMBL146180 0.71 LMNA (0.63) LMNAMAPTKMT2AALDH1A1ELANE

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
CN-109983083-A Antifouling composition 佐敦有限公司 2019-07-05 CN disclosed