SCHEMBL17280878

SCHEMBL17280878

CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cc(-c5cc(-c6cc(-c7cccc(-c8ccc9c(c8)C(C)(C)c8ccccc8-9)c7)c7ccccc7c6)ncn5)cc5ccccc45)c3)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 8/20 0.34
▸ CA12 O43570 3/20 0.33
▸ CA1 P00915 3/20 0.33
▸ CA2 P00918 3/20 0.33
▸ CA9 Q16790 3/20 0.33
▸ HSD17B1 P14061 1/20 0.33
▸ HSD17B2 P37059 1/20 0.33
▸ KMO O15229 1/20 0.33
▸ TGFBR1 P36897 1/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ PIK3CB P42338 1/20 0.32
▸ MTOR P42345 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ ENPP3 O14638 1/20 0.32
▸ ENPP1 P22413 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 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
SCHEMBL17280861 0.87 PDK2 (0.38) PDK2KMO
SCHEMBL17273403 0.86 KMO (0.42) PDK2KMO
SCHEMBL17273276 0.86 KMO (0.42) PDK2KMO
SCHEMBL17280875 0.86 KMO (0.42) PDK2KMO
SCHEMBL17280872 0.85 PDK2 (0.41) PDK2KMOKMT2A
SCHEMBL22274548 0.83 KMT2A (0.46) PDK2KDM4EMEN1ALDH1A1MAPT
SCHEMBL31624137 0.82 PIM1 (0.34) PDK2HSD17B1HSD17B2KDM4EMEN1
SCHEMBL25533606 0.81 ENPP3 (0.38) PDK2CA12CA1CA2CA9
SCHEMBL17280863 0.81 PDK2 (0.41) PDK2
SCHEMBL25533584 0.80 ALDH1A1 (0.39) PDK2CA12CA1CA2CA9

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210013421-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-01-14 — — US disclosed
US-10770660-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2020-09-08 — — US disclosed
US-20180198073-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2018-07-12 — — US disclosed
US-20180198073-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2018-07-12 — — US disclosed
US-9923149-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2018-03-20 — — US disclosed
US-9923149-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2018-03-20 — — US disclosed
US-20150340622-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-11-26 — — US disclosed
US-20150340622-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-11-26 — — 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 (4 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-20150340622-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device CRY1, GNA11, CYP1A1 PDK2 1856/4885CA12 2059/4885CA1 2154/4885
US-10770660-B2 Heterocyclic compound, light-emitting element, light-emitting device, electronic device, and lighting device CRY1, GNA11, CYP1A1 PDK2 1856/4885CA12 2059/4885CA1 2154/4885
US-20210013421-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device CRY1, GNA11, CYP1A1 PDK2 1856/4885CA12 2059/4885CA1 2154/4885
US-20180198073-A1 Heterocyclic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device CRY1, GNA11, CYP1A1 PDK2 1856/4885CA12 2059/4885CA1 2154/4885

“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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