SCHEMBL12060867

SCHEMBL12060867

CN(c1ccc(N=O)cc1)c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc4ccccc34)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ SIGMAR1 Q99720 11/20 0.37
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ PDE5A O76074 2/20 0.33
▸ DHFR P00374 1/20 0.32
▸ ABCG2 Q9UNQ0 1/20 0.32

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
SCHEMBL12060557 1.00 ALDH1A1 (0.38) ALDH1A1TP53TSHRMAPK1HIF1A
SCHEMBL12060561 0.97 SIGMAR1 (0.40) ALDH1A1TP53TSHRMAPK1HIF1A
SCHEMBL12060265 0.95 ALDH1A1 (0.40) ALDH1A1TP53TSHRMAPK1HIF1A
SCHEMBL12567697 0.94 SIGMAR1 (0.36) ALDH1A1TP53TSHRMAPK1HIF1A
SCHEMBL12060552 0.93 SIGMAR1 (0.43) ALDH1A1TP53TSHRMAPK1HIF1A
SCHEMBL12060768 0.93 SIGMAR1 (0.37) ALDH1A1TP53TSHRMAPK1HIF1A
SCHEMBL12060520 0.91 ALDH1A1 (0.43) ALDH1A1TP53TSHRMAPK1HIF1A
SCHEMBL12060556 0.90 SIGMAR1 (0.37) SIGMAR1PDE5ADHFRABCG2
SCHEMBL12060868 0.90 SIGMAR1 (0.37) SIGMAR1PDE5ADHFRABCG2
SCHEMBL12047992 0.89 SIGMAR1 (0.45) ALDH1A1TSHRHIF1ASIGMAR1SLC6A2

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 9 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-20110127495-A1 NEW COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME LG CHEM, LTD. (KR) 2011-06-02 — — 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-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-20080093983-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 (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-20110127495-A1 NEW COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME PPOX, CYBA, CRY1 ALDH1A1 90/4885TP53 3716/4885TSHR 4651/4885
US-20100065827-A1 COMPOUNDS AND ORGANIC LIGHT EMITTING DIODE USING THE SAME VDAC1, PER2, PPOX ALDH1A1 69/4885TP53 4247/4885TSHR 4219/4885
US-20080303434-A1 Compound and Organic Light Emitting Device Using the Same PPOX, CRY1, CRY2 ALDH1A1 318/4885TP53 3665/4885TSHR 3910/4885
US-20100065828-A1 COMPOUNDS AND ORGANIC LIGHT EMITTING DIODE USING THE SAME VDAC1, PER2, PPOX ALDH1A1 69/4885TP53 4247/4885TSHR 4219/4885

“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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