SCHEMBL13487461

SCHEMBL13487461

Cc1ccc2c(-c3ccc(C(F)(F)F)cc3)c3ccccc3c(-c3ccc4c(c3)-c3ccccc3C4(C)C)c2c1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 9/20 0.43
KIF11 P52732 4/20 0.34
ENPP1 P22413 2/20 0.34
MAPT P10636 1/20 0.32
EPHX2 P34913 2/20 0.31
TOP1 P11387 1/20 0.31

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
SCHEMBL13487825 0.93 PDK2 (0.43) PDK2KIF11ENPP1MAPT
SCHEMBL13487776 0.89 PDK2 (0.38) PDK2
SCHEMBL13487528 0.89 KIF11 (0.41) PDK2KIF11MAPT
SCHEMBL13487043 0.88 PDK2 (0.36) PDK2KIF11ENPP1MAPT
SCHEMBL13487437 0.87 PDK2 (0.40) PDK2
SCHEMBL13487445 0.86 MAPT (0.39) PDK2MAPT
SCHEMBL13487615 0.86 EPHX2 (0.36) PDK2ENPP1EPHX2
SCHEMBL13487733 0.86 ESR1 (0.35) PDK2EPHX2
SCHEMBL13650953 0.85 PDK2 (0.37) PDK2
SCHEMBL13488141 0.85 PDK2 (0.40) PDK2

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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 US disclosed
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 PDK2 1456/4885KIF11 2202/4885ENPP1 626/4885

“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.