SCHEMBL36453

SCHEMBL36453

Cc1ccc2ccccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 11/20 1.00
TDP1 Q9NUW8 1/20 1.00
CYP1A2 P05177 10/20 0.77
ALDH1A1 P00352 4/20 0.48
CYP3A4 P08684 2/20 0.48
HSD17B10 Q99714 2/20 0.48
CYP2C9 P11712 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NQO2 P16083 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
ALOX12 P18054 1/20 0.47

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
SCHEMBL29372904 1.00 CYP2A6 (1.00) CYP2A6TDP1CYP1A2ALDH1A1CYP3A4
SCHEMBL28081333 1.00 CYP2A6 (1.00) CYP2A6TDP1CYP1A2ALDH1A1CYP3A4
Ethane SCHEMBL11323050 0.97 CYP2A6 (0.94) CYP2A6TDP1CYP1A2ALDH1A1CYP3A4
Lithium SCHEMBL31073469 0.97 CYP2A6 (0.94) CYP2A6TDP1CYP1A2ALDH1A1CYP3A4
SCHEMBL28850499 0.97 CYP2A6 (0.94) CYP2A6TDP1CYP1A2ALDH1A1CYP3A4
SCHEMBL10886090 0.97 CYP2A6 (0.94) CYP2A6TDP1CYP1A2ALDH1A1CYP3A4
SCHEMBL10886086 0.97 CYP2A6 (0.94) CYP2A6TDP1CYP1A2ALDH1A1CYP3A4
Methane SCHEMBL16096368 0.97 CYP2A6 (0.94) CYP2A6TDP1CYP1A2ALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL7988310 0.97 CYP2A6 (0.94) CYP2A6TDP1CYP1A2ALDH1A1CYP3A4
SCHEMBL28514959 0.97 CYP2A6 (0.94) CYP2A6TDP1CYP1A2ALDH1A1CYP3A4

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

Appears in 24583 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12637417-B2 Method for producing 2-(halogenated methyl)naphthalene and 2-naphthyl acetonitrile UBE CORPORATION (JP) 2026-05-26 US claimed
US-20260100408-A1 SOLID ELECTROLYTE MATERIAL AND BATTERY TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 2026-04-09 US claimed
US-20260070794-A1 ELECTRODE MATERIAL AND PREPARATION METHOD THEREOF, ELECTRODE PLATE AND PREPARATION METHOD THEREOF, BATTERY, AND ELECTRIC APPARATUS CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2026-03-12 US claimed
EP-4693591-A1 ELECTRODE MATERIAL AND PREPARATION METHOD THEREFOR, ELECTRODE SHEET AND PREPARATION METHOD THEREFOR, BATTERY AND ELECTRIC DEVICE Contemporary Amperex Technology Co., Limited (CN) 2026-02-11 EP claimed
EP-4188585-B1 METHOD OF PRODUCING CARBON MOLECULAR SIEVE MEMBRANES DOW GLOBAL TECHNOLOGIES LLC (US) 2025-11-19 EP claimed
US-12472482-B2 Method of producing carbon molecular sieve membranes DOW GLOBAL TECHNOLOGIES LLC (US) 2025-11-18 US claimed
EP-4615667-A1 INJECTION MOLDING COMPOSITIONS COMPRISING RECYCLED POLYAMIDES RECOVERED UPON EXPLOITATION OF OFF-SHORE OR ON-SHORE OIL OR GAS DEPOSITS ARKEMA FRANCE (FR) 2025-09-17 EP claimed
EP-4615666-A1 EXTRUSION COMPOSITIONS COMPRISING RECYCLED POLYAMIDES RECOVERED UPON EXPLOITATION OF OFF-SHORE OR ON-SHORE OIL OR GAS DEPOSITS ARKEMA FRANCE (FR) 2025-09-17 EP claimed
US-20250257431-A1 PRELITHIATED ELECTRODE MATERIAL AND PREPARATION METHOD THEREOF, SECONDARY BATTERY, AND ELECTRICAL DEVICE CONTEMPORARY AMPEREX TECHNOLOGY (HONG KONG) LIMITED (CN) 2025-08-14 US claimed
US-20250210621-A1 HIGH PERFORMANCE ANODE ELECTRODE INCLUDING SILICON FILM WITH CONTROLLED PRE-LITHIATION GM Global Technology Operations LLC 2025-06-26 US claimed
EP-0016546-A1 Extracellular microbial lipoheteropolysaccharides and derivatives, their preparation and compositions containing them, and their uses Petroleum Fermentations N.V. (AN) 1980-10-01 EP claimed
US-4217300-A Preparation of dihalogenovinylcyclopropanecarboxylic acids and esters BAYER AKTIENGESELLSCHAFT (DE) 1980-08-12 US claimed
US-4187255-A ALUMINA ALKYLATION CATALYSTS CONOCO, INC. (US) 1980-02-05 US claimed
US-4179580-A CONDENSATION OF AN OLEFIN WITH A COMPOUND CONTAINING ACTIVE HYDROGENS IN THE PRESENCE OF A ALKALI METAL ANT TITANIUM PHILLIPS PETROLEUM COMPANY (US) 1979-12-18 US claimed
US-4097598-A Quaternary salts as hypoglycemic agents PFIZER INC. (US) 1978-06-27 US claimed
US-4044015-A Imidazopyridinium compounds as hypoglycemic agents PFIZER INC. (US) 1977-08-23 US claimed
US-4021542-A Derivatives of hydrazino-monosaccharides and aldohexoses which are useful as intermediates for preparing compounds or as compounds which lower the uric acid BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) 1977-05-03 US claimed
US-4011145-A ELECTROCHEMICAL MANUFACTURE OF AROMATIC ESTERS BASF AKTIENGESELLSCHAFT (DT) 1977-03-08 US claimed
US-3961095-A ALKYL NAPHTHALENE, FOODS, BEVERAGES FIRMENICH & CIE (CH) 1976-06-01 US claimed
US-3952024-A FLAVOR ADDITIVE FOR FOODS AND BEVERAGES FIRMENICH & CIE (CH) 1976-04-20 US claimed