SCHEMBL12060552

SCHEMBL12060552

CN(c1ccc(N=O)cc1)c1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 12/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ NR3C2 P08235 1/20 0.34
▸ DHFR P00374 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 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
SCHEMBL12060561 0.96 SIGMAR1 (0.40) SIGMAR1ALDH1A1TP53TSHRMAPK1
SCHEMBL12060520 0.94 ALDH1A1 (0.43) SIGMAR1ALDH1A1TP53TSHRMAPK1
SCHEMBL12060867 0.93 ALDH1A1 (0.38) SIGMAR1ALDH1A1TP53TSHRMAPK1
SCHEMBL12060557 0.93 ALDH1A1 (0.38) SIGMAR1ALDH1A1TP53TSHRMAPK1
SCHEMBL31548609 0.93 SIGMAR1 (0.41) SIGMAR1ALDH1A1TP53TSHRMAPK1
SCHEMBL12060768 0.92 SIGMAR1 (0.37) SIGMAR1ALDH1A1TP53TSHRMAPK1
SCHEMBL12060553 0.91 SIGMAR1 (0.40) SIGMAR1DHFR
SCHEMBL12567697 0.91 SIGMAR1 (0.36) SIGMAR1ALDH1A1TP53TSHRMAPK1
SCHEMBL12060265 0.90 ALDH1A1 (0.40) SIGMAR1ALDH1A1TP53TSHRMAPK1
SCHEMBL279524 0.88 SIGMAR1 (0.51) SIGMAR1DHFRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8071227-B2 Compounds and organic light emitting diode using the same LG CHEM, LTD. (KR) 2011-12-06 — — US disclosed
US-20110168992-A1 NOVEL COMPOUND, METHOD FOR PREPARING SAME AND ORGANIC ELECTRONIC DEVICE USING SAME LG CHEM, LTD. (KR) 2011-07-14 — — US disclosed
US-20110127495-A1 NEW COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME LG CHEM, LTD. (KR) 2011-06-02 — — US disclosed
US-7842405-B2 a fluorene derivative capable of significantly improving a lifespan, efficiency, and electrochemical and thermal stability LG CHEM, LTD. (KR) 2010-11-30 — — US disclosed
US-7842404-B2 Compound and organic light emitting device using the same LG CHEM, LTD. (KR) 2010-11-30 — — US disclosed
US-7816019-B2 Compound and organic light emitting device using the same LG CHEM, LTD. (KR) 2010-10-19 — — US disclosed
US-7811682-B2 Compound and organic light emitting device using the same LG CHEM, LTD. (KR) 2010-10-12 — — US disclosed
US-20100065827-A1 COMPOUNDS AND ORGANIC LIGHT EMITTING DIODE USING THE SAME LG CHEM, LTD. (KR) 2010-03-18 — — US disclosed
US-20100065828-A1 COMPOUNDS AND ORGANIC LIGHT EMITTING DIODE USING THE SAME LG CHEM, LTD. (KR) 2010-03-18 — — US disclosed
US-20090200542-A1 Compounds and Organic Light Emitting Device Using the Same LG CHEM, LTD. (KR) 2009-08-13 — — US disclosed
US-20090045721-A1 Compound and organic light emitting device using the same LG CHEM, LTD. (KR) 2009-02-19 — — US disclosed
US-20080303434-A1 Compound and Organic Light Emitting Device Using the Same LG CHEM, LTD. (KR) 2008-12-11 — — US disclosed
US-20080093982-A1 Compound and Organic Light Emitting Device Using the Same LG CHEM, LTD. (KR) 2008-04-24 — — 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 (6 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-20090200542-A1 Compounds and Organic Light Emitting Device Using the Same CYBA, LOXL1, OGDH SIGMAR1 3870/4885ALDH1A1 5/4885TP53 4794/4885
US-20110127495-A1 NEW COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME PPOX, CYBA, CRY1 SIGMAR1 3635/4885ALDH1A1 90/4885TP53 3716/4885
US-20100065827-A1 COMPOUNDS AND ORGANIC LIGHT EMITTING DIODE USING THE SAME VDAC1, PER2, PPOX SIGMAR1 1904/4885ALDH1A1 69/4885TP53 4247/4885
US-20080303434-A1 Compound and Organic Light Emitting Device Using the Same PPOX, CRY1, CRY2 SIGMAR1 4092/4885ALDH1A1 318/4885TP53 3665/4885
US-20100065828-A1 COMPOUNDS AND ORGANIC LIGHT EMITTING DIODE USING THE SAME VDAC1, PER2, PPOX SIGMAR1 1904/4885ALDH1A1 69/4885TP53 4247/4885
US-20110168992-A1 NOVEL COMPOUND, METHOD FOR PREPARING SAME AND ORGANIC ELECTRONIC DEVICE USING SAME OR10J3, USE1, NOTUM SIGMAR1 2924/4885ALDH1A1 1288/4885TP53 4715/4885

“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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