SCHEMBL1273375

SCHEMBL1273375

c1ccc2cc3c(cc2c1)-c1cccc2c1c-3cc1ccccc12

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.88
HSD17B10 Q99714 7/20 0.88
TSHR P16473 4/20 0.88
HPGD P15428 4/20 0.88
MAPK1 P28482 3/20 0.88
HIF1A Q16665 3/20 0.88
CASP1 P29466 3/20 0.88
L3MBTL1 Q9Y468 2/20 0.88
CASP7 P55210 2/20 0.64
TP53 P04637 1/20 0.64
CYP1A2 P05177 4/20 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
ATM Q13315 1/20 0.46
CYP1B1 Q16678 1/20 0.44
THRB P10828 1/20 0.44
HKDC1 Q2TB90 1/20 0.44

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 SCHEMBL29503670 0.93 ALDH1A1 (1.00) ALDH1A1HSD17B10TSHRHPGDMAPK1
Benzo[B]Fluoranthene SCHEMBL30626366 0.93 ALDH1A1 (1.00) ALDH1A1HSD17B10TSHRHPGDMAPK1
Benzo[B]Fluoranthene SCHEMBL175779 0.93 ALDH1A1 (1.00) ALDH1A1HSD17B10TSHRHPGDMAPK1
Benzo[B]Fluoranthene SCHEMBL29373899 0.93 ALDH1A1 (1.00) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL29433166 0.88 ALDH1A1 (0.75) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL29433165 0.88 ALDH1A1 (0.75) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL29433167 0.88 ALDH1A1 (0.75) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL1628778 0.87 ALDH1A1 (0.72) ALDH1A1HSD17B10TSHRHPGDMAPK1
Benzo[B]Fluoranthene SCHEMBL25399455 0.86 ALDH1A1 (0.85) ALDH1A1HSD17B10TSHRHPGDMAPK1
SCHEMBL10304488 0.85 CASP1 (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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
WO-2020040462-A1 COMPOSITION COMPRISING PLANT EXTRACT AS EFFECTIVE INGREDIENT FOR PREVENTING OR TREATING PARTICULATE MATTER-INDUCED RESPIRATORY DISEASE 주식회사 성균바이오텍 2020-02-27 WO disclosed
EP-2464616-B1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KK (JP) 2014-10-29 EP disclosed
EP-2464616-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME Canon Kabushiki Kaisha (JP) 2012-06-20 EP disclosed
US-20110148292-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-06-23 US disclosed
WO-2011018886-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2011-02-17 WO 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20110148292-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING THE SAME RPS24, OR10J3, ORC3 ALDH1A1 600/4885HSD17B10 2852/4885TSHR 1486/4885

“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.