SCHEMBL21895009

SCHEMBL21895009

c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc5c(c4)C(c4ccccc4)(c4ccc(Oc6ccc7c(c6)CC7)cc4)c4ccccc4-5)cc3)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccc(Oc4ccc5c(c4)CC5)cc2)c2ccccc2-3)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.34
▸ ADORA1 P30542 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ KIF11 P52732 1/20 0.31
▸ MAPK14 Q16539 1/20 0.31
▸ MAOA P21397 1/20 0.30
▸ MAOB P27338 1/20 0.30

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
SCHEMBL21895008 1.00 PDK2 (0.35) PDK2HRH3ADORA1KDM4EMEN1
SCHEMBL21895005 0.99 PDK2 (0.36) PDK2HRH3ADORA1KDM4EMEN1
SCHEMBL21894878 0.98 PDK2 (0.35) PDK2HRH3ADORA1KDM4EMEN1
SCHEMBL21793638 0.98 PDK2 (0.37) PDK2HRH3ADORA1KDM4EMEN1
SCHEMBL23713891 0.94 PDK2 (0.35) PDK2HRH3ADORA1
SCHEMBL21793199 0.94 ADORA1 (0.33) PDK2HRH3ADORA1LMNASMN1; SMN2
SCHEMBL21895004 0.94 PDK2 (0.38) PDK2HRH3ADORA1KIF11
SCHEMBL21895048 0.94 PDK2 (0.35) PDK2HRH3ADORA1
SCHEMBL22332094 0.94 PDK2 (0.38) PDK2HRH3ADORA1KIF11
SCHEMBL22485152 0.94 PDK2 (0.35) PDK2HRH3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807767-B2 Ink composition for organic light emitting device LG CHEM, LTD. 2023-11-07 — — US disclosed
US-11807767-B2 Ink composition for organic light emitting device LG CHEM, LTD. 2023-11-07 — — US disclosed
US-20230043088-A1 Organic Light Emitting Device LG CHEM, LTD. (KR) 2023-02-09 — — US disclosed
US-11472966-B2 Coating composition, organic light-emitting diode using same and method for preparing same LG CHEM, LTD. 2022-10-18 — — US disclosed
US-11377570-B2 Ink composition for organic light emitting device LG CHEM, LTD. 2022-07-05 — — US disclosed
US-11274213-B2 Compound, coating composition comprising same, organic light-emitting diode using same, and method for preparing same LG CHEM, LTD. 2022-03-15 — — US disclosed
US-20210277269-A1 Ink Composition for Organic Light Emitting Device LG CHEM, LTD. (KR) 2021-09-09 — — US disclosed
US-20210221932-A1 Novel Polymer and Organic Light Emitting Device Comprising the Same LG CHEM, LTD. (KR) 2021-07-22 — — US disclosed
EP-3789464-A1 INK COMPOSITION FOR ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2021-03-10 — — EP disclosed
US-20200308435-A1 Ink Composition for Organic Light Emitting Device LG CHEM, LTD. (KR) 2020-10-01 — — US disclosed
US-20200259095-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Diode Using Same, and Method for Preparing Same LG CHEM, LTD. (KR) 2020-08-13 — — US disclosed
WO-2020067800-A1 INK COMPOSITION FOR ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2020-04-02 — — WO 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 (3 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-20200259095-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Diode Using Same, and Method for Preparing Same SEM1, SETDB1, ORMDL3 PDK2 4040/4885HRH3 3758/4885ADORA1 1490/4885
US-11472966-B2 Coating composition, organic light-emitting diode using same and method for preparing same OR10J3, SEM1, ORMDL3 PDK2 4353/4885HRH3 3658/4885ADORA1 2564/4885
US-11274213-B2 Compound, coating composition comprising same, organic light-emitting diode using same, and method for preparing same SEM1, SETDB1, ORMDL3 PDK2 4040/4885HRH3 3758/4885ADORA1 1490/4885

“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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