SCHEMBL13508103

SCHEMBL13508103

c1ccc2c(-c3ccc(-c4ccc5c(c4)oc4c6oc7cc(-c8cccc9ccccc89)ccc7c6c6ccccc6c54)cc3)cccc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.45
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
CA9 Q16790 3/20 0.45
MCL1 Q07820 1/20 0.40
ACMSD Q8TDX5 1/20 0.40
ENPP3 O14638 1/20 0.40
ENPP1 P22413 1/20 0.40
ALOX5 P09917 1/20 0.40
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 2/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
PRKDC P78527 1/20 0.37
MAP1LC3B Q9GZQ8 1/20 0.36

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
SCHEMBL13508029 0.96 MCL1 (0.42) CA12CA1CA2CA9MCL1
SCHEMBL13508117 0.93 CYP1A1 (0.42) CA12CA1CA2CA9MCL1
SCHEMBL13508222 0.93 CA12 (0.42) CA12CA1CA2CA9ENPP3
SCHEMBL13507180 0.90 CA12 (0.46) CA12CA1CA2CA9MCL1
SCHEMBL17577229 0.88 CA12 (0.40) CA12CA1CA2CA9MCL1
SCHEMBL17577220 0.88 CA12 (0.40) CA12CA1CA2CA9MCL1
SCHEMBL17577216 0.88 CA12 (0.43) CA12CA1CA2CA9MCL1
SCHEMBL17577217 0.87 ALOX5 (0.42) CA12CA1CA2CA9MCL1
SCHEMBL17577219 0.87 CA12 (0.40) CA12CA1CA2CA9MCL1
SCHEMBL13507139 0.85 MCL1 (0.43) CA12CA1CA2CA9MCL1

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-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 US disclosed
US-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 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-20100032658-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 CA12 3624/4885CA1 4267/4885CA2 2258/4885

“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.