SCHEMBL3799787

SCHEMBL3799787

CC(C)(C)[Si](C)(C)OCc1ccccc1C1=C(c2ccccc2)C(c2ccccc2)=C(c2ccccc2CO[Si](C)(C)C(C)(C)C)C1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.42
PREP P48147 2/20 0.39
MITF O75030 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PDE4B Q07343 1/20 0.35
PTPN1 P18031 3/20 0.35
TACR1 P25103 2/20 0.34
FGFR1 P11362 3/20 0.34
FGFR2 P21802 3/20 0.34
FGFR4 P22455 3/20 0.34
FGFR3 P22607 3/20 0.34
HSP90AA1 P07900 2/20 0.34
HSP90AB1 P08238 2/20 0.34
CDC25A P30304 1/20 0.34
CDC25B P30305 1/20 0.34
SRC P12931 1/20 0.34
P2RX7 Q99572 1/20 0.33

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
SCHEMBL3796508 0.81 BACE1 (0.37) BACE1PREPTACR1
SCHEMBL3799785 0.81 PREP (0.43) PREPPDE4BTACR1PTGS2
SCHEMBL3799755 0.72 CRHBP (0.35) BACE1MAPTTOP2A
SCHEMBL3978083 0.71 BACE1 (0.38) BACE1TACR1
SCHEMBL7981998 0.71 RECQL (0.45) BACE1ALDH1A1MAPT
SCHEMBL30219107 0.71 BACE1 (0.56) BACE1ALDH1A1HTTTACR1
SCHEMBL2082920 0.71 BACE1 (0.56) BACE1ALDH1A1HTTTACR1
SCHEMBL31094071 0.70 BACE1 (0.49) BACE1ALDH1A1HTT
SCHEMBL6673753 0.70 BACE1 (0.49) BACE1ALDH1A1HTT
SCHEMBL1065745 0.69 MAPT (0.39) BACE1ALDH1A1MAPTHTTHSP90AA1

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-20100222432-A1 Synthetic Carbon Nanotubes KANSAS STATE UNIVERSITY RESEARCH FOUNDATION 2010-09-02 US disclosed
WO-2008048227-A2 SYNTHETIC CARBON NANOTUBES KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) 2008-04-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100222432-A1 Synthetic Carbon Nanotubes CYCS, CHN2, TUBA3C BACE1 4710/4885PREP 4609/4885MITF 3729/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.