SCHEMBL915686

SCHEMBL915686

Cc1ccccc1Nc1ccc([Si](C)(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
MEN1 O00255 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
MAPK10 P53779 1/20 0.42
SLC2A1 P11166 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
ADRA1D P25100 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 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
SCHEMBL108882 0.85 MAPT (0.54) TDP1MEN1MAPK1KMT2AL3MBTL1
SCHEMBL29653984 0.85 MAPT (0.54) TDP1MEN1MAPK1KMT2AL3MBTL1
SCHEMBL29940926 0.79 HPGD (0.60) TDP1MEN1MAPK1KMT2AL3MBTL1
SCHEMBL3686455 0.79 GAA (0.64) TDP1MEN1KMT2AL3MBTL1MAPT
SCHEMBL5697158 0.79 HPGD (0.60) TDP1MEN1MAPK1KMT2AL3MBTL1
SCHEMBL512863 0.79 MAPT (0.48) TDP1MEN1MAPK1KMT2AL3MBTL1
SCHEMBL13232841 0.79 TSHR (0.46) TDP1MEN1MAPK1KMT2AMAPT
SCHEMBL304152 0.79 MAPT (0.56) TDP1MEN1MAPK1KMT2AL3MBTL1
SCHEMBL19087503 0.78 ALDH1A1 (0.56) RAB9AALDH1A1LMNA
SCHEMBL915984 0.78 RAPGEF4 (0.52) MEN1MAPK1KMT2AL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8647754-B2 Aromatic diamine derivative and organic electroluminescent device using the same IDEMITSU KOSAN CO., LTD. (JP) 2014-02-11 US disclosed
US-20110006289-A1 AROMATIC DIAMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2011-01-13 US disclosed
US-20080102311-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2008-05-01 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 (2 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-20080102311-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT EMPLOYING THE SAME L1CAM, EML4, EBPL TDP1 1085/4885MEN1 1200/4885MAPK1 1870/4885
US-20110006289-A1 AROMATIC DIAMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME AOC1, DDC, CCNL2 TDP1 1764/4885MEN1 1230/4885MAPK1 412/4885

“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.