Sugi Predict

Sugi Predict / Compounds / SCHEMBL2302722

SCHEMBL2302722

SCHEMBL2302722

c1ccc2c(c1)-c1cccc3c1c-2cc1c2ccccc2ccc31

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.71
▸ HSD17B10 Q99714 6/20 0.71
▸ TSHR P16473 4/20 0.71
▸ HPGD P15428 3/20 0.71
▸ MAPK1 P28482 3/20 0.71
▸ HIF1A Q16665 3/20 0.71
▸ L3MBTL1 Q9Y468 2/20 0.71
▸ CASP1 P29466 2/20 0.71
▸ HPRT1 P00492 4/20 0.54
▸ CYP1A2 P05177 3/20 0.50
▸ ERBB2 P04626 1/20 0.50
▸ FYN P06241 1/20 0.50
▸ MAOA P21397 1/20 0.50
▸ ACHE P22303 1/20 0.50
▸ AHR P35869 1/20 0.50
▸ THRB P10828 1/20 0.50
▸ ATM Q13315 1/20 0.46
▸ CYP2A6 P11509 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ CYP1B1 Q16678 1/20 0.45

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
Benzo[B]Fluoranthene SCHEMBL25399455 0.92 ALDH1A1 (0.85) ALDH1A1HSD17B10TSHRHPGDMAPK1
Benzo(K)Fluoranthene SCHEMBL3432727 0.92 ALDH1A1 (0.66) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL17070126 0.88 MAPK1 (0.56) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL29433167 0.87 ALDH1A1 (0.75) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL29433165 0.87 ALDH1A1 (0.75) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL29433166 0.87 ALDH1A1 (0.75) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL30103570 0.86 HPRT1 (0.61) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL14227010 0.84 ALDH1A1 (0.61) ALDH1A1HSD17B10TSHRHPGDMAPK1
Triphenylene SCHEMBL5783342 0.84 ALDH1A1 (0.62) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL29489957 0.84 ALDH1A1 (0.70) ALDH1A1HSD17B10TSHRHPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110240983-A1 TRIAZINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-10-06 — — US claimed
US-12227625-B2 Composite materials comprising mechanical ligands NANOCORE APS (DK) 2025-02-18 — — US disclosed
EP-4119598-A1 NANOCOMPOSITE MATERIALS COMPRISING MECHANICAL LIGANDS Nanocore ApS (DK) 2023-01-18 — — EP disclosed
EP-3737711-B1 COMPOSITE MATERIALS COMPRISING MECHANICAL LIGANDS NANOCORE APS (DK) 2022-04-06 — — EP disclosed
EP-3737711-A1 COMPOSITE MATERIALS COMPRISING MECHANICAL LIGANDS Nanocore Aps (DK) 2020-11-18 — — EP disclosed
US-20200354220-A1 COMPOSITE MATERIALS COMPRISING MECHANICAL LIGANDS NANOCORE APS (DK) 2020-11-12 — — US disclosed
US-20160141506-A1 NAPHTHO[2,1-b]FLUORANTHENE COMPOUND, ORGANIC LIGHT-EMITTING DEVICE, DISPLAY APPARATUS, LIGHTING APPARATUS, IMAGE FORMING APPARATUS, AND EXPOSING APPARATUS CANON KABUSHIKI KAISHA (JP) 2016-05-19 — — US disclosed
US-8932736-B2 Organic compound and organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2015-01-13 — — US disclosed
US-8765270-B2 Triazine compound and organic light emitting device using the same CANON KABUSHIKI KAISHA (JP) 2014-07-01 — — US disclosed
US-8431244-B2 Indenochrysene derivative and organic light-emitting device using same CANON KABUSHIKI KAISHA (JP) 2013-04-30 — — US disclosed
US-20120313085-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2012-12-13 — — US disclosed
US-20110240983-A1 TRIAZINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-10-06 — — US disclosed
WO-2011102102-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2011-08-25 — — WO disclosed
US-20100127618-A1 INDENOCHRYSENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE USING SAME CANON KABUSHIKI KAISHA (JP) 2010-05-27 — — US disclosed
US-7470290-B2 Hydroscopic polymer gels for easier cleaning THE CLOROX COMPANY (US) 2008-12-30 — — US disclosed
US-7183010-B2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CORPORATION (US) 2007-02-27 — — US disclosed
US-20050245428-A1 Hydroscopic polymer gels for easier cleaning RODRIGUES KLIN A 2005-11-03 — — US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 — — US disclosed
EP-0039085-A1 Process for increasing the solubility of aromatic systems Langhals, Heinz, Dr. (DE) 1981-11-04 — — 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-20120313085-A1 NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE MRPL38, CRY1, TYR ALDH1A1 459/4885HSD17B10 2784/4885TSHR 2220/4885
US-20100127618-A1 INDENOCHRYSENE DERIVATIVE AND ORGANIC LIGHT-EMITTING DEVICE USING SAME OR51E2, INTS9, ORAI2 ALDH1A1 63/4885HSD17B10 1335/4885TSHR 3848/4885
US-20160141506-A1 NAPHTHO[2,1-b]FLUORANTHENE COMPOUND, ORGANIC LIGHT-EMITTING DEVICE, DISPLAY APPARATUS, LIGHTING APPARATUS, IMAGE FORMING APPARATUS, AND EXPOSING APPARATUS NAP1L1, NR0B2, AFF1 ALDH1A1 479/4885HSD17B10 602/4885TSHR 2452/4885
US-20110240983-A1 TRIAZINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME TERT, CYP1A1, NR2E3 ALDH1A1 44/4885HSD17B10 1689/4885TSHR 952/4885

“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.