SCHEMBL13615758

SCHEMBL13615758

CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc5c(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)c6cc(N(c7ccc(-c8ccc9c(c8)C(C)(C)c8ccccc8-9)cc7)c7cccc8ccccc78)ccc6c(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)c5c4)c4cccc5ccccc45)cc3)cc21

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.31
▸ SIGMAR1 Q99720 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
SCHEMBL13333913 0.99 PDK2 (0.31) PDK2SIGMAR1
SCHEMBL13333763 0.97 PDK2 (0.31) PDK2SIGMAR1
SCHEMBL12014685 0.95 SIGMAR1 (0.32) PDK2SIGMAR1
SCHEMBL13766286 0.94 SIGMAR1 (0.32) SIGMAR1
SCHEMBL13333986 0.93 MCL1 (0.32) SIGMAR1
SCHEMBL10153150 0.92 SIGMAR1 (0.34) PDK2SIGMAR1
SCHEMBL15081536 0.91 PDK2 (0.33) PDK2
SCHEMBL13333598 0.91 PIM1 (0.30) SIGMAR1
SCHEMBL12770684 0.91 CA12 (0.33) PDK2
SCHEMBL12770689 0.91 DHFR (0.31) PDK2SIGMAR1

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-20090273277-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-11-05 — — US disclosed
US-20090273277-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-11-05 — — 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-20090273277-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, ORMDL3, CHRM2 PDK2 2656/4885SIGMAR1 966/4885

“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.

Send feedback