SCHEMBL13104646

SCHEMBL13104646

CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4)c4cc(-c5ccc6c(c5)C(C)(C)c5cc(-c7cc(N(c8ccccc8)c8ccc(-c9ccc%10c(c9)C(C)(C)c9ccccc9-%10)cc8)cc(N(c8ccccc8)c8ccc(-c9ccc%10c(c9)C(C)(C)c9ccccc9-%10)cc8)c7)ccc5-6)cc(N(c5ccccc5)c5ccc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)c4)cc3)cc21

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 19/20 0.40

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
SCHEMBL17180537 0.99 PDK2 (0.43) PDK2
SCHEMBL19448857 0.99 PDK2 (0.41) PDK2
SCHEMBL17180552 0.97 PDK2 (0.43) PDK2
SCHEMBL18311827 0.97 PDK2 (0.39) PDK2
SCHEMBL17740655 0.96 PDK2 (0.39) PDK2
SCHEMBL13104634 0.96 PDK2 (0.39) PDK2
SCHEMBL12378967 0.96 PDK2 (0.43) PDK2
SCHEMBL13104688 0.95 PDK2 (0.40) PDK2
SCHEMBL17465480 0.94 PDK2 (0.43) PDK2
SCHEMBL12378963 0.94 PDK2 (0.43) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7807277-B2 Amine compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2010-10-05 — — US disclosed
US-7807277-B2 Amine compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2010-10-05 — — US disclosed
US-20080124573-A1 AMINE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2008-05-29 — — US disclosed
US-20080124573-A1 AMINE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2008-05-29 — — 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-20080124573-A1 AMINE COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE AHR, HTR1D, TPH1 PDK2 3523/4885

“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.

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