SCHEMBL3976910

SCHEMBL3976910

c1ccc2cc3c(cc2c1)cc1ccc2cccc4ccc3c1c24

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.73
ERBB2 P04626 1/20 0.73
FYN P06241 1/20 0.73
MAOA P21397 1/20 0.73
ACHE P22303 1/20 0.73
AHR P35869 1/20 0.73
ALDH1A1 P00352 9/20 0.56
HSD17B10 Q99714 7/20 0.56
HPGD P15428 6/20 0.56
THRB P10828 1/20 0.56
TSHR P16473 3/20 0.48
CYP3A4 P08684 3/20 0.48
TDP1 Q9NUW8 3/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CYP1B1 Q16678 3/20 0.48
CYP1A1 P04798 2/20 0.48
HIF1A Q16665 3/20 0.44
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL29944899 1.00 CYP1A2 (0.73) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4853313 0.98 CYP1A2 (0.70) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4846699 0.98 CYP1A2 (0.70) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL27594413 0.96 CYP1A2 (0.74) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4851540 0.96 CYP1A2 (0.72) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL11299909 0.93 CYP1A2 (0.61) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL11797942 0.93 CYP1A2 (0.61) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4761722 0.92 CYP1A2 (0.74) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4853653 0.91 CYP1A2 (0.61) CYP1A2ERBB2FYNMAOAACHE
SCHEMBL4853917 0.90 CYP1A2 (0.85) CYP1A2ERBB2FYNMAOAACHE

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 79 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240122062-A1 PEROVSKITE-SENSITIZED NEAR-INFRARED-TO-GREEN UPCONVERSION FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2024-04-11 US claimed
US-20180072863-A1 METHOD OF MAKING GRAPHENE COMPOSITIONS VORBECK MATERIALS CORP. (US) 2018-03-15 US claimed
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
CN-1330412-C Gas storage method and system, and gas occluding material TOYOTA AUTOCAR CO LTD (JP) 2007-08-08 CN claimed
US-6391283-B1 APPLYING TO TEETH BLEACHING COMPOSITION THAT COMPRISES DENTAL BLEACHING AGENT AND DYE NOT ENTIRELY BLEACHED PRIOR TO USE, EXPOSING TO RADIANT ENERGY SO DYE ABSORBS PORTION OF ENERGY, CAUSING BLEACHING AGENT TO HEAT UP AND ACCELERATE BLEACHING ULTRADENT PRODUCTS, INC. 2002-05-21 US claimed
US-6387353-B1 STABLE RADIANT ENERGY ABSORBING DYE ACTIVATOR; ONE-PART, PREMIXED VISCOUS/GELLED DENTAL BLEACH OF HIGH CONCENTRATION; HYDROGEN PEROXIDE OR CARBAMIDE PEROXIDE ULTRADENT PRODUCTS, INC. 2002-05-14 US claimed
EP-0989827-A1 STABLE LIGHT OR HEAT ACTIVATED DENTAL BLEACHING COMPOSITIONS ULTRADENT PRODUCTS, INC. (US) 2000-04-05 EP claimed
WO-1999037236-A1 METHODS AND APPARATUS FOR ACTIVATING DENTAL COMPOSITIONS ULTRADENT PRODUCTS, INC. (US) 1999-07-29 WO claimed
WO-1998030169-A1 STABLE LIGHT OR HEAT ACTIVATED DENTAL BLEACHING COMPOSITIONS ULTRADENT PRODUCTS, INC. (US) 1998-07-16 WO claimed
US-12227625-B2 Composite materials comprising mechanical ligands NANOCORE APS (DK) 2025-02-18 US disclosed
US-20240122062-A1 PEROVSKITE-SENSITIZED NEAR-INFRARED-TO-GREEN UPCONVERSION FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2024-04-11 US disclosed
WO-2023177271-A1 ORGANIC ELECTROLUMINESCENT DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-09-21 WO disclosed
WO-2023149635-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2023-08-10 WO disclosed
WO-2023149717-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2023-08-10 WO disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
CN-85107531-A Process for producing vinyl chloride polymer 1987-01-21 CN disclosed
EP-0172427-A2 Process for production of vinyl chloride polymer Shin-Etsu Chemical Co., Ltd. (JP) 1986-02-26 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