SCHEMBL4845352

SCHEMBL4845352

c1ccc2c(c1)ccc1cc3c4ccccc4c4ccccc4c3cc12

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.84
HSD17B10 Q99714 4/20 0.84
CYP1B1 Q16678 2/20 0.84
HIF1A Q16665 1/20 0.84
HPRT1 P00492 4/20 0.65
CYP2A6 P11509 1/20 0.63
TSHR P16473 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
CYP1A2 P05177 5/20 0.59
HPGD P15428 2/20 0.59
PAX8 Q06710 1/20 0.52
TRPM4 Q8TD43 1/20 0.52
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
ERBB2 P04626 1/20 0.46
FYN P06241 1/20 0.46
MAOA P21397 1/20 0.46
ACHE P22303 1/20 0.46
AHR P35869 1/20 0.46
THRB P10828 1/20 0.46

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
SCHEMBL31010418 1.00 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL31010417 1.00 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL10775482 1.00 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL29736749 1.00 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4849253 0.97 ALDH1A1 (0.80) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4851928 0.97 ALDH1A1 (0.80) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4854680 0.97 ALDH1A1 (0.80) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL30327475 0.97 ALDH1A1 (0.80) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4846387 0.92 ALDH1A1 (0.80) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1
SCHEMBL4853205 0.92 ALDH1A1 (0.89) ALDH1A1HSD17B10CYP1B1HIF1AHPRT1

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 29 patents — showing the first 20. 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
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-9885793-B2 Method and apparatus for neutron detection utilizing pulse height discrimination and pulse shape discrimination NANOPTICS, INCORPORATED (US) 2018-02-06 US disclosed
US-9461260-B2 Organic light emitting device CANON KABUSHIKI KAISHA (JP) 2016-10-04 US disclosed
US-9331296-B2 Organic light-emitting device CANON KABUSHIKI KAISHA (JP) 2016-05-03 US disclosed
US-20150241574-A1 METHOD AND APPARATUS FOR NEUTRON DETECTION UTILIZING PULSE HEIGHT DISCRIMINATION AND PULSE SHAPE DISCRIMINATION NANOPTICS, INCORPORATED 2015-08-27 US disclosed
US-6768132-B2 MULTILAYER INTEGRATED CIRCUIT; BARRIER DIELECTRIC AND SEMICONDUCTOR 3M INNOVATIVE PROPERTIES COMPANY 2004-07-27 US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed
US-20030175551-A1 Surface modified organic thin film transistors 3M INNOVATIVE PROPERTIES COMPANY 2003-09-18 US disclosed
WO-2003077327-A1 ORGANIC THIN FILM TRANSISTORS WITH MODIFIED SURFACE OF GATE-DIELECTRIC 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-09-18 WO disclosed
EP-0450862-B1 Organic thin film element TOSHIBA KK (JP) 1999-06-30 EP disclosed
US-5354869-A Fluorescent dyes RIEDEL-DE HAEN AKTIENGESELLSCHAFT (DE) 1994-10-11 US disclosed
US-5155566-A ORGANIC THIN FILM ELEMENT KABUSHIKI KAISHA TOSHIBA (JP) 1992-10-13 US disclosed
EP-0450862-A2 Organic thin film element KABUSHIKI KAISHA TOSHIBA (JP) 1991-10-09 EP disclosed
EP-0039085-A1 Process for increasing the solubility of aromatic systems Langhals, Heinz, Dr. (DE) 1981-11-04 EP disclosed
US-3965049-A One-step synthesis of aromatic organic diselenides XEROX CORPORATION (US) 1976-06-22 US disclosed