SCHEMBL2810486

SCHEMBL2810486

Cc1ccc2ccccc2c1C.[NaH]

nearest known ligand 0.95

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 6/20 0.95
CYP1A2 P05177 6/20 0.95
TSHR P16473 5/20 0.95
ALDH1A1 P00352 6/20 0.54
HSD17B10 Q99714 5/20 0.52
TDP1 Q9NUW8 2/20 0.52
HPGD P15428 3/20 0.50
HIF1A Q16665 2/20 0.50
CYP3A4 P08684 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
MAPK1 P28482 1/20 0.50
CASP1 P29466 1/20 0.50
RAB9A P51151 1/20 0.50
CASP7 P55210 1/20 0.50
ATM Q13315 1/20 0.50
HPRT1 P00492 1/20 0.48
CYP1B1 Q16678 1/20 0.44
MAPT P10636 2/20 0.42
NCEH1 Q6PIU2 1/20 0.42
LCK P06239 1/20 0.42

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
SCHEMBL28814927 0.97 CYP2A6 (1.00) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL49861 0.97 CYP2A6 (1.00) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL29736830 0.97 CYP2A6 (1.00) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL28536959 0.95 CYP2A6 (0.95) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL31498531 0.95 CYP2A6 (0.95) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL2810487 0.95 CYP2A6 (0.95) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
Hydrogen Sulfide SCHEMBL28221773 0.95 CYP2A6 (0.95) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL9614419 0.95 CYP2A6 (0.95) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
SCHEMBL10684038 0.95 CYP2A6 (0.95) CYP2A6CYP1A2TSHRALDH1A1HSD17B10
Methane SCHEMBL16097895 0.95 CYP2A6 (0.95) CYP2A6CYP1A2TSHRALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0991745-A1 ADDITIVE FOR A DETERGENT FORMULATION, DETERGENT FORMULATION COMPRISING SUCH AN ADDITIVE AND USE OF SAID FORMATION FOR CLEANING BOTTLES UNILEVER N.V. (NL) 2000-04-12 EP claimed
WO-1998059027-A1 ADDITIVE FOR A DETERGENT FORMULATION, DETERGENT FORMULATION COMPRISING SUCH AN ADDITIVE AND USE OF SAID FORMATION FOR CLEANING BOTTLES UNILEVER N.V. (NL) 1998-12-30 WO claimed
CN-120048847-A Ultrasonic enhanced pre-sodified hard carbon negative electrode plate, preparation method and sodium ion battery 西安交通大学 2025-05-27 CN disclosed
CN-116947532-A High-efficiency roughening and self-cleaning treatment method 北控水务建设发展有限公司 2023-10-27 CN disclosed
WO-2023114226-A1 OPACIFYING AGENTS EFCO PRODUCTS, INC. (US) 2023-06-22 WO disclosed
US-20230180805-A1 Opacifying Agents EFCO Products Inc. (US) 2023-06-15 US disclosed
US-20220325200-A1 SOLID SURFACTANT COMPOSITIONS BASF SE (DE) 2022-10-13 US disclosed
EP-4025677-A1 SOLID SURFACTANT COMPOSITIONS BASF SE (DE) 2022-07-13 EP disclosed
WO-2021043999-A1 SOLID SURFACTANT COMPOSITIONS BASF SE (DE) 2021-03-11 WO disclosed
EP-2207416-B1 ENHANCED RETENTION CAPABILITIES THROUGH METHODS COMPRISING SURFACE TREATMENT OF FUNCTIONAL PARTICULATE CARRIER MATERIALS, AND FUNCTIONAL PARTICULATE CARRIER MATERIALS MADE THEREFROM IMERYS FILTRATION MINERALS INC (US) 2018-11-07 EP disclosed
CN-101883485-A Enhanced retention through a process comprising surface treatment of functional particulate support materials and functional particulate support materials made therefrom WORLD MINERALS INC 2010-11-10 CN disclosed
EP-0623670-A2 Aqueous based surfactant compositions ALBRIGHT & WILSON UK LIMITED (GB) 1994-11-09 EP disclosed
US-4832802-A USING A SULFIDE-CONTAINING POLYETHER OR ALKYLENE OXIDE ADDUCT AND AN ACETYLENIC ALCOHOL MCGEAN-ROHCO, INC. (US) 1989-05-23 US disclosed
US-4717555-A Anticaking and antidusting composition for ammonium nitrate DESOTO, INC. (US) 1988-01-05 US disclosed
US-4689251-A Anticaking and antidusting composition DESOTO, INC. (US) 1987-08-25 US disclosed
US-4600450-A Microknit composite explosives and processes for making same MEGABAR EXPLOSIVES CORPORATION (US) 1986-07-15 US disclosed
EP-0152060-A1 Composite explosives and processes for making same Megabar Corporation (US) 1985-08-21 EP disclosed
US-4384930-A Electroplating baths, additives therefor and methods for the electrodeposition of metals MCGEAN-ROHCO, INC. (US) 1983-05-24 US disclosed
US-4229268-A SULFUR-CONTAINING POLYOXYALKYLENE GLYCOL IN BATHS ROHCO, INC. (US) 1980-10-21 US disclosed
US-4162947-A AROMATIC SULFONIC ACID OR SALT, ZINC AND AMMONIUM COMPOUNDS R. O. HULL & COMPANY, INC. (US) 1979-07-31 US disclosed