SCHEMBL12660720

SCHEMBL12660720

C[Si](C)(C)COc1ccc(N)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.58
TSHR P16473 2/20 0.58
MAPK1 P28482 1/20 0.46
MAOB P27338 4/20 0.45
MAPT P10636 4/20 0.45
RAB9A P51151 3/20 0.45
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAOA P21397 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 5/20 0.44
CYP3A4 P08684 2/20 0.44
APP P05067 2/20 0.42
NPC1 O15118 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
APAF1 O14727 1/20 0.42
TEAD4 Q15561 1/20 0.41
LTA4H P09960 1/20 0.41
PTGS1 P23219 1/20 0.41

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
SCHEMBL2194744 0.83 TDP1 (0.54) TDP1TSHRMAPK1MAOBMAPT
SCHEMBL10938457 0.79 TDP1 (0.50) TDP1TSHRMAPK1MAOBMAPT
SCHEMBL23532379 0.79 CA12 (0.52) TSHRMAPK1MAPTRAB9ASMN1; SMN2
SCHEMBL11316263 0.78 TDP1 (0.48) TDP1TSHRMAPK1MAOBMAPT
SCHEMBL11311338 0.78 TDP1 (0.48) TDP1TSHRMAPK1MAOBMAPT
SCHEMBL8443089 0.77 LTA4H (0.52) APPKMT2AMEN1LTA4HPTGS1
SCHEMBL14090012 0.77 NQO1 (0.39) TDP1TSHRMAPTGAASMN1; SMN2
SCHEMBL4704964 0.76 KCNA3 (0.50) TDP1ALDH1A1LTA4H
SCHEMBL11314136 0.75 TDP1 (0.46) TDP1TSHRMAPK1MAOBMAPT
SCHEMBL18883707 0.74 MAOB (0.44) MAOBMAPTGAASMN1; SMN2ALDH1A1

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-7939666-B2 Enzyme inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-05-10 US disclosed
US-20090291978-A1 Enzyme Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2009-11-26 US 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-20090291978-A1 Enzyme Inhibitors HAT1, NR2E1, NR2C2 TDP1 3073/4885TSHR 1357/4885MAPK1 2308/4885

“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.