SCHEMBL4138766

SCHEMBL4138766

O=[N+]([O-])c1ccccc1-c1cc2ccccc2c2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPRT1 P00492 1/20 0.57
▸ ALDH1A1 P00352 6/20 0.56
▸ TDP1 Q9NUW8 3/20 0.54
▸ TSHR P16473 2/20 0.54
▸ CASP6 P55212 1/20 0.53
▸ CYP3A4 P08684 2/20 0.52
▸ LMNA P02545 1/20 0.48
▸ MAOB P27338 2/20 0.47
▸ MAPT P10636 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ GUSB P08236 1/20 0.47
▸ F2 P00734 1/20 0.47
▸ C1R P00736 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ MAPK1 P28482 3/20 0.43
▸ HIF1A Q16665 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43

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
SCHEMBL2627610 0.88 HPRT1 (0.71) HPRT1ALDH1A1TDP1TSHRCASP6
SCHEMBL2627636 0.87 ALDH1A1 (0.57) HPRT1ALDH1A1TDP1TSHRCASP6
SCHEMBL17300253 0.84 GABRA1 (0.52) HPRT1ALDH1A1TDP1TSHRCASP6
SCHEMBL15821069 0.84 HPRT1 (0.65) HPRT1ALDH1A1TDP1TSHRCASP6
SCHEMBL17841980 0.84 HPRT1 (0.65) HPRT1ALDH1A1TDP1TSHRCASP6
SCHEMBL24732110 0.83 ALDH1A1 (0.50) HPRT1ALDH1A1TDP1TSHRCASP6
SCHEMBL17063444 0.83 ALDH1A1 (0.54) HPRT1ALDH1A1TDP1TSHRCASP6
SCHEMBL22155094 0.82 MAPT (0.50) HPRT1ALDH1A1TDP1TSHRCASP6
SCHEMBL22127145 0.82 HPRT1 (0.50) HPRT1ALDH1A1TDP1TSHRCASP6
SCHEMBL1903204 0.82 HPRT1 (0.50) HPRT1ALDH1A1TDP1TSHRCASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10651397-B2 Organic light emitting compound and organic light emitting device comprising the same SFC CO., LTD. (KR) 2020-05-12 — — US disclosed
EP-2463352-B1 Light emitting device material and light emitting device TORAY INDUSTRIES (JP) 2018-05-02 — — EP disclosed
EP-1942171-B1 LIGHT-EMITTING DEVICE MATERIAL AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES (JP) 2018-04-18 — — EP disclosed
US-9722188-B2 Material for organic electronic device, and organic electronic device using the same LG CHEM, LTD. (KR) 2017-08-01 — — US disclosed
US-9722188-B2 Material for organic electronic device, and organic electronic device using the same LG CHEM, LTD. (KR) 2017-08-01 — — US disclosed
WO-2016175533-A2 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2016-11-03 — — WO disclosed
US-20160248024-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME SFC CO., LTD. (KR) 2016-08-25 — — US disclosed
US-20160248024-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME SFC CO., LTD. (KR) 2016-08-25 — — US disclosed
US-20150349275-A1 CONDENSED CYCLIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-03 — — US disclosed
US-20150349275-A1 CONDENSED CYCLIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-12-03 — — US disclosed
EP-2757106-A1 Substituted benzimidazole phosphine compounds and a method for decarboxylating carbon-carbon bond Saltigo GmbH (DE) 2014-07-23 — — EP disclosed
US-20140061629-A1 LIGHT-EMITTING DEVICE MATERIAL AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2014-03-06 — — US disclosed
US-8610345-B2 Light-emitting device material and light-emitting device TORAY INDUSTRIES, INC. (JP) 2013-12-17 — — US disclosed
EP-2463352-A2 Light emitting device material and light emitting device Toray Industries, Inc. (JP) 2012-06-13 — — EP disclosed
EP-2463351-A2 Light emitting device material and light emitting device Toray Industries, Inc. (JP) 2012-06-13 — — EP disclosed
US-20110210318-A1 MATERIAL FOR ORGANIC ELECTRONIC DEVICE, AND ORGANIC ELECTRONIC DEVICE USING SAME LG CHEM, LTD. (KR) 2011-09-01 — — US disclosed
US-20110210318-A1 MATERIAL FOR ORGANIC ELECTRONIC DEVICE, AND ORGANIC ELECTRONIC DEVICE USING SAME LG CHEM, LTD. (KR) 2011-09-01 — — US disclosed
EP-2332911-A2 MATERIAL FOR ORGANIC ELECTRONIC DEVICE, AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG Chem, Ltd. (KR) 2011-06-15 — — EP disclosed
US-20090096356-A1 Light-emitting device material and light-emitting device TORAY INDUSTRIES, INC. (JP) 2009-04-16 — — US disclosed
EP-1942171-A1 LIGHT-EMITTING DEVICE MATERIAL AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2008-07-09 — — EP 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-20090096356-A1 Light-emitting device material and light-emitting device PRMT9, CCNL2, MRPL9 HPRT1 693/4885ALDH1A1 1929/4885TDP1 4016/4885
US-20110210318-A1 MATERIAL FOR ORGANIC ELECTRONIC DEVICE, AND ORGANIC ELECTRONIC DEVICE USING SAME OR51E2, OR10J3, EML4 HPRT1 1217/4885ALDH1A1 969/4885TDP1 2092/4885
US-10651397-B2 Organic light emitting compound and organic light emitting device comprising the same MAP1LC3C, CRY1, MAP1LC3A HPRT1 24/4885ALDH1A1 459/4885TDP1 1355/4885
US-20160248024-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME MAP1LC3C, CRY1, MAP1LC3A HPRT1 24/4885ALDH1A1 459/4885TDP1 1355/4885

“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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