SCHEMBL10871323

SCHEMBL10871323

O=[N+]([O-])c1c(I)ccc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.62
▸ CYP3A4 P08684 1/20 0.60
▸ ALDH1A1 P00352 3/20 0.50
▸ NCEH1 Q6PIU2 1/20 0.48
▸ HPRT1 P00492 2/20 0.47
▸ HSP90AA1 P07900 1/20 0.46
▸ CRHBP P24387 1/20 0.46
▸ CRHR2 Q13324 1/20 0.46
▸ S100A4 P26447 1/20 0.44
▸ HNF4A P41235 2/20 0.44
▸ TDP1 Q9NUW8 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ RXRA P19793 1/20 0.40
▸ CASP6 P55212 1/20 0.40
▸ HTT P42858 1/20 0.38

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
SCHEMBL187452 0.78 TSHR (0.65) TSHRCYP3A4ALDH1A1NCEH1HPRT1
SCHEMBL3071816 0.77 TSHR (0.62) TSHRCYP3A4ALDH1A1NCEH1HPRT1
SCHEMBL5249317 0.77 TSHR (0.62) TSHRCYP3A4ALDH1A1NCEH1HPRT1
SCHEMBL1710125 0.77 TSHR (1.00) TSHRCYP3A4ALDH1A1NCEH1HPRT1
SCHEMBL7936527 0.77 TSHR (0.62) TSHRCYP3A4ALDH1A1NCEH1HPRT1
SCHEMBL767775 0.77 TSHR (0.62) TSHRCYP3A4ALDH1A1NCEH1HPRT1
SCHEMBL3699674 0.77 TSHR (0.62) TSHRCYP3A4ALDH1A1NCEH1HPRT1
SCHEMBL15617271 0.77 TSHR (0.62) TSHRCYP3A4ALDH1A1NCEH1HPRT1
SCHEMBL2026504 0.77 TSHR (0.62) TSHRCYP3A4ALDH1A1NCEH1HPRT1
SCHEMBL17987525 0.77 TSHR (0.62) TSHRCYP3A4ALDH1A1NCEH1HPRT1

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-10763443-B2 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof DUK SAN NEOLUX CO., LTD (KR) 2020-09-01 — — US disclosed
US-10672992-B2 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof DUK SAN NEOLUX CO., LTD (KR) 2020-06-02 — — US disclosed
US-10446762-B2 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2019-10-15 — — US disclosed
US-20190173023-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2019-06-06 — — US disclosed
US-20180083204-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2018-03-22 — — US disclosed
US-20180083204-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2018-03-22 — — US disclosed
US-20160005981-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2016-01-07 — — US disclosed
US-20160005981-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2016-01-07 — — US disclosed
US-20160005981-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2016-01-07 — — US disclosed
WO-2014104585-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산하이메탈(주) (KR) 2014-07-03 — — WO disclosed
WO-2014104585-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산하이메탈(주) (KR) 2014-07-03 — — WO disclosed
EP-0195229-A2 Cookware formed from a laminate AMOCO CORPORATION (US) 1986-09-24 — — 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 (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-20190173023-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF NFE2L2, OR51E2, ESR1 TSHR 4573/4885CYP3A4 1323/4885ALDH1A1 859/4885
US-10763443-B2 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof NFE2L2, OR51E2, ESR1 TSHR 4573/4885CYP3A4 1323/4885ALDH1A1 859/4885
US-20180083204-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF NFE2L2, OR51E2, ESR1 TSHR 4573/4885CYP3A4 1323/4885ALDH1A1 859/4885
US-10672992-B2 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof NFE2L2, OR51E2, ESR1 TSHR 4573/4885CYP3A4 1323/4885ALDH1A1 859/4885
US-20160005981-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREOF NFE2L2, OR51E2, ESR1 TSHR 4573/4885CYP3A4 1323/4885ALDH1A1 859/4885
US-10446762-B2 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof NFE2L2, OR51E2, ESR1 TSHR 4573/4885CYP3A4 1323/4885ALDH1A1 859/4885

“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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