SCHEMBL1268952

SCHEMBL1268952

CCCC(C)=NO[Si](ON=C(C)CCC)(ON=C(C)CCC)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.37
CES1 P23141 4/20 0.37
MAPT P10636 2/20 0.36
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
GAA P10253 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.33
MAPK1 P28482 2/20 0.33
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALOX5 P09917 1/20 0.31
TP53 P04637 1/20 0.31
ESR1 P03372 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL29488783 0.86 MAOB (0.38) CES2CES1MAPTMAOAMAOB
SCHEMBL531137 0.86 MAOB (0.38) CES2CES1MAPTMAOAMAOB
SCHEMBL6669859 0.78 RAB9A (0.40) MAPTMAOAMAOBSMN1; SMN2L3MBTL1
SCHEMBL2050414 0.77 MAPT (0.39) MAPTL3MBTL1MAPK1LMNAHTT
SCHEMBL2050412 0.77 MAPT (0.39) MAPTL3MBTL1MAPK1LMNAHTT
SCHEMBL28545178 0.74 NPC1 (0.44) MAPTSMN1; SMN2L3MBTL1MAPK1LMNA
SCHEMBL3300226 0.71 MAOB (0.38) MAPTMAOAMAOBL3MBTL1MAPK1
SCHEMBL213003 0.71 MAOB (0.38) MAPTMAOAMAOBL3MBTL1MAPK1
SCHEMBL1269399 0.71 MAPT (0.32) MAPTL3MBTL1MAPK1LMNAHTT
SCHEMBL213002 0.71 MAOB (0.38) MAPTMAOAMAOBL3MBTL1MAPK1

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-20110028639-A1 ROOM TEMPERATURE VULCANIZABLE POLYMERS HONEYWELL INTERNATIONAL, INC. (US) 2011-02-03 US claimed

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-20110028639-A1 ROOM TEMPERATURE VULCANIZABLE POLYMERS TET3, KDM3A, TET1 CES2 3821/4885CES1 3924/4885MAPT 2899/4885

“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.