SCHEMBL13487233

SCHEMBL13487233

CC1(C)c2ccccc2-c2c(-c3c4ccccc4c(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)c4ccc(-c5cccc6ccccc56)cc34)cccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.34
ACMSD Q8TDX5 1/20 0.34
ENPP3 O14638 1/20 0.34
ENPP1 P22413 1/20 0.34
CHRNA1 P02708 1/20 0.30
CHRNG P07510 1/20 0.30
CHRNB1 P11230 1/20 0.30
CHRNB2 P17787 1/20 0.30
SLC6A2 P23975 1/20 0.30
CHRNB4 P30926 1/20 0.30
SLC6A4 P31645 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30
SLC6A3 Q01959 1/20 0.30
CHRND Q07001 1/20 0.30
EDNRB P24530 1/20 0.30
EDNRA P25101 1/20 0.30
PPARG P37231 3/20 0.30
PPARA Q07869 3/20 0.30
CYP2C19 P33261 2/20 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
SCHEMBL13487330 0.91 ESR1 (0.31)
SCHEMBL13487154 0.90 PDK2 (0.32)
SCHEMBL13487640 0.89 MCL1 (0.34) MCL1ACMSDENPP3ENPP1CHRNA1
SCHEMBL13488026 0.89 ENPP3 (0.36) MCL1ACMSDENPP3ENPP1CHRNA1
SCHEMBL13487426 0.88 PDK2 (0.33)
SCHEMBL13487078 0.87 PDK2 (0.32) ENPP1
SCHEMBL13487174 0.87 MAPK11 (0.38) MCL1ACMSDENPP3ENPP1CHRNA1
SCHEMBL13487167 0.86 MCL1 (0.33) MCL1ACMSDENPP3ENPP1CHRNA1
SCHEMBL13487191 0.86 MCL1 (0.36) MCL1ACMSDENPP3ENPP1CHRNA1
SCHEMBL13487189 0.85 SCN5A (0.35) MCL1ACMSDENPP1CHRNA1CHRNG

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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 MCL1 2343/4885ACMSD 191/4885ENPP3 1230/4885

“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.