SCHEMBL887953

SCHEMBL887953

C=Cc1ccc(OCC(C)(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.50
CHRNB2 P17787 1/20 0.50
CHRNB4 P30926 1/20 0.50
CHRNA3 P32297 1/20 0.50
CHRNA4 P43681 1/20 0.50
ALDH1A1 P00352 4/20 0.44
XDH P47989 1/20 0.37
HIF1A Q16665 1/20 0.36
EPAS1 Q99814 1/20 0.36
RELA Q04206 1/20 0.36
TP53 P04637 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
PDK2 Q15119 1/20 0.35
TSHR P16473 1/20 0.34
NQO1 P15559 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
PPARA Q07869 3/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 2/20 0.33

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
SCHEMBL6287454 0.83 CHRNA7 (0.50) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL13141341 0.82 NQO1 (0.48) ALDH1A1XDHHIF1ATP53PDK2
SCHEMBL6289229 0.81 CHRNA7 (0.56) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL17829482 0.80 CHRNB2 (0.44) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL16901826 0.80 ALDH1A1 (0.52) ALDH1A1XDHRAB9AMAPTMEN1
SCHEMBL14341692 0.80 CHRNA7 (0.46) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL2998505 0.80 CHRNB2 (0.46) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL24383545 0.79 CHRNB2 (0.43) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL274523 0.77 CHRNB2 (0.44) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL181498 0.77 NQO1 (0.64) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230309369-A1 Organic Light-Emitting Device LG CHEM, LTD. (KR) 2023-09-28 US disclosed
US-20230309369-A1 Organic Light-Emitting Device LG CHEM, LTD. (KR) 2023-09-28 US disclosed
US-11765921-B2 Ionic compound, and coating composition and organic light-emitting device comprising same LG CHEM, LTD. 2023-09-19 US disclosed
US-11765921-B2 Ionic compound, and coating composition and organic light-emitting device comprising same LG CHEM, LTD. 2023-09-19 US disclosed
US-11737300-B2 Coating composition and organic light-emitting device LG CHEM, LTD. (KR) 2023-08-22 US disclosed
US-11737300-B2 Coating composition and organic light-emitting device LG CHEM, LTD. (KR) 2023-08-22 US disclosed
US-11581490-B2 Organic light emitting diode LG CHEM, LTD. 2023-02-14 US disclosed
US-11572346-B2 Compound, coating composition comprising same, and organic light-emitting device LG CHEM, LTD. 2023-02-07 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-20220085292-A1 Organic Light Emitting Device LG CHEM, LTD. (KR) 2022-03-17 US disclosed
US-11127904-B2 Compound, coating composition comprising same, organic light emitting device using same, and manufacturing method thereof LG CHEM, LTD. 2021-09-21 US disclosed
US-20210151681-A1 Organic Light Emitting Diode LG CHEM, LTD. (KR) 2021-05-20 US disclosed
US-20210147358-A1 Compound, Coating Composition Comprising Same, and Organic Light-Emitting Device LG CHEM, LTD. (KR) 2021-05-20 US disclosed
US-20200227645-A1 Ionic Compound, And Coating Composition And Organic Light-emitting Device Comprising Same LG CHEM, LTD. (KR) 2020-07-16 US disclosed
US-20200055803-A1 COMPOUND, COATING COMPOSITION COMPRISING SAME, ORGANIC LIGHT-EMITTING DEVICE USING SAME AND METHOD FOR PREPARING SAME LG CHEM, LTD. (KR) 2020-02-20 US disclosed
US-20190280206-A1 Coating Composition And Organic Light-emitting Device LG CHEM, LTD. (KR) 2019-09-12 US disclosed
CN-102344537-B Block copolymer and polymer composition prepared therefrom CHI MEI CORP 2014-04-16 CN disclosed
US-8598272-B2 Compatibilizer and blend polymer composition including the same CHI MEI CORPORATION (TW) 2013-12-03 US disclosed
CN-102344537-A Block copolymer and polymer composition prepared therefrom CHI MEI CORP 2012-02-08 CN disclosed
US-20120010363-A1 COMPATIBILIZER AND BLEND POLYMER COMPOSITION INCLUDING THE SAME CHI MEI CORPORATION (TW) 2012-01-12 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 (8 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-20210147358-A1 Compound, Coating Composition Comprising Same, and Organic Light-Emitting Device OR10J3, CRY1, CRY2 CHRNA7 1052/4885CHRNB2 1406/4885CHRNB4 1741/4885
US-11127904-B2 Compound, coating composition comprising same, organic light emitting device using same, and manufacturing method thereof SEM1, FTO, SETDB1 CHRNA7 1663/4885CHRNB2 2490/4885CHRNB4 3307/4885
US-11572346-B2 Compound, coating composition comprising same, and organic light-emitting device OR10J3, CRY1, CRY2 CHRNA7 1052/4885CHRNB2 1406/4885CHRNB4 1741/4885
US-11472966-B2 Coating composition, organic light-emitting diode using same and method for preparing same OR10J3, SEM1, ORMDL3 CHRNA7 731/4885CHRNB2 1620/4885CHRNB4 2141/4885
US-20200227645-A1 Ionic Compound, And Coating Composition And Organic Light-emitting Device Comprising Same OR10J3, ORC3, CD59 CHRNA7 255/4885CHRNB2 448/4885CHRNB4 612/4885
US-11765921-B2 Ionic compound, and coating composition and organic light-emitting device comprising same OR10J3, ORC3, CD59 CHRNA7 255/4885CHRNB2 448/4885CHRNB4 612/4885
US-20200055803-A1 COMPOUND, COATING COMPOSITION COMPRISING SAME, ORGANIC LIGHT-EMITTING DEVICE USING SAME AND METHOD FOR PREPARING SAME SEM1, SETDB1, GPS1 CHRNA7 1293/4885CHRNB2 2259/4885CHRNB4 3133/4885
US-11737300-B2 Coating composition and organic light-emitting device CD59, CLTB, EPCAM CHRNA7 341/4885CHRNB2 368/4885CHRNB4 490/4885

“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.