SCHEMBL4852383

SCHEMBL4852383

c1ccc2c(c1)cc1c3ccccc3c3cc4ccccc4c4ccc2c1c43

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.59
HSD17B10 Q99714 4/20 0.59
HIF1A Q16665 2/20 0.59
CYP1B1 Q16678 2/20 0.59
CYP1A2 P05177 3/20 0.58
ERBB2 P04626 1/20 0.58
FYN P06241 1/20 0.58
MAOA P21397 1/20 0.58
ACHE P22303 1/20 0.58
AHR P35869 1/20 0.58
HPRT1 P00492 3/20 0.57
HPGD P15428 3/20 0.52
THRB P10828 1/20 0.52
TRPM4 Q8TD43 1/20 0.52
TSHR P16473 2/20 0.52
MAPK1 P28482 1/20 0.52
CASP1 P29466 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
CYP2A6 P11509 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL4854639 0.97 ALDH1A1 (0.56) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL5475597 0.93 CYP1A2 (0.57) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL29731903 0.91 CYP1A2 (0.73) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL55922 0.91 CYP1A2 (0.73) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL5471233 0.90 CYP1A2 (0.65) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL4846672 0.90 HSD17B10 (0.52) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL4849338 0.89 CYP1A2 (0.64) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL4854138 0.89 CYP1A2 (0.64) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL4848683 0.89 CYP1A2 (0.70) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2
SCHEMBL5477664 0.87 ALDH1A1 (0.56) ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8961830-B2 Electroactive polymers containing pendant pi-interacting/binding substituents, their carbon nanotube composites, and processes to form the same UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-02-24 US claimed
EP-4674238-A1 HOLE-SELECTIVE CONTACT MATERIAL, PHOTOELECTRIC CONVERSION DEVICE AND POLYCYCLIC AROMATIC HYDROCARBON COMPOUND Okinawa Institute of Science and Technology School Corporation (JP) 2026-01-07 EP disclosed
US-12227625-B2 Composite materials comprising mechanical ligands NANOCORE APS (DK) 2025-02-18 US disclosed
WO-2024181467-A1 HOLE-SELECTIVE CONTACT MATERIAL, PHOTOELECTRIC CONVERSION DEVICE AND POLYCYCLIC AROMATIC HYDROCARBON COMPOUND OKINAWA INSTITUTE OF SCIENCE AND TECHNOLOGY SCHOOL CORPORATION (JP) 2024-09-06 WO 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-7470290-B2 Hydroscopic polymer gels for easier cleaning THE CLOROX COMPANY (US) 2008-12-30 US disclosed
EP-1359790-B1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CO (US) 2008-10-29 EP 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-1359790-A2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY (US) 2003-11-05 EP disclosed
US-3968051-A VINYL RESIN, POLYAROMATIC MATERIAL AMERICAN CYANAMID COMPANY (US) 1976-07-06 US disclosed
US-3965049-A One-step synthesis of aromatic organic diselenides XEROX CORPORATION (US) 1976-06-22 US disclosed