SCHEMBL112792

SCHEMBL112792

COc1ccc2ccccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 1.00
CYP2A6 P11509 1/20 1.00
RAB9A P51151 4/20 0.59
NQO2 P16083 3/20 0.59
LMNA P02545 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
HTT P42858 1/20 0.58
PPARG P37231 1/20 0.56
NPC1 O15118 3/20 0.56
KDM4E B2RXH2 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
HSD17B1 P14061 1/20 0.56
HSD17B2 P37059 1/20 0.56
ALDH1A1 P00352 1/20 0.56
POLB P06746 1/20 0.56
ACHE P22303 2/20 0.53
ALOX5 P09917 1/20 0.53

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
SCHEMBL5311432 1.00 CYP1A2 (1.00) CYP1A2CYP2A6RAB9ANQO2LMNA
SCHEMBL29353188 1.00 CYP1A2 (1.00) CYP1A2CYP2A6RAB9ANQO2LMNA
Naphthalene SCHEMBL18344242 0.97 CYP1A2 (0.95) CYP1A2CYP2A6RAB9ANQO2LMNA
Ethane SCHEMBL28740950 0.97 CYP1A2 (0.95) CYP1A2CYP2A6RAB9ANQO2LMNA
Methane SCHEMBL9286464 0.97 CYP1A2 (0.95) CYP1A2CYP2A6RAB9ANQO2LMNA
Water SCHEMBL17079094 0.97 CYP1A2 (0.95) CYP1A2CYP2A6RAB9ANQO2LMNA
SCHEMBL11884025 0.97 CYP1A2 (0.95) CYP1A2CYP2A6RAB9ANQO2LMNA
SCHEMBL27498364 0.97 CYP1A2 (0.95) CYP1A2CYP2A6RAB9ANQO2LMNA
Methyl Alcohol SCHEMBL5664821 0.95 CYP1A2 (0.91) CYP1A2CYP2A6RAB9ANQO2LMNA
Ethylene SCHEMBL9815947 0.95 CYP1A2 (0.91) CYP1A2CYP2A6RAB9ANQO2LMNA

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 8173 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4214303-B1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2026-05-06 EP claimed
US-12559703-B2 Fragrance composition GIVAUDAN SA (CH) 2026-02-24 US claimed
US-12522786-B2 Organic compounds GIVAUDAN SA (CH) 2026-01-13 US claimed
US-20250302728-A1 FRAGRANCE COMPOSITIONS AND PRODUCTS CONVEYING A POSITIVE MOOD SYMRISE AG (DE) 2025-10-02 US claimed
US-12421475-B2 High performing, high impact bloom accord with a top, medium, and base note mixture INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2025-09-23 US claimed
US-12404479-B2 Laundry detergent composition containing graft copolymer and benefit agent THE PROCTER & GAMBLE COMPANY (US) 2025-09-02 US 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-12378500-B2 Liquid laundry product comprising a fragrance composition comprising isopulegol TAKASAGO INTERNATIONAL CORPORATION (JP) 2025-08-05 US claimed
US-20250235136-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2025-07-24 US claimed
EP-3919044-B1 COMPOSITION AND METHOD FOR IMPROVING FRAGRANCE INTENSITY WITH ISOPROPYL MYRISTATE INT FLAVORS & FRAGRANCES INC (US) 2025-07-02 EP claimed
US-4493904-A COORDINATION, POLYMERIZATION CATALYST CONTAINING TITANIUM TRICHORI CONOCO INC. (US) 1985-01-15 US claimed
EP-0108156-A1 Improved method for the preparation of non-crystalline polymers of high molecular weight Conoco Phillips Company (US) 1984-05-16 EP claimed
US-4358572-A POLYMERIZATION OF ALPH-OLEFINS USING A CATALYTIC SLURRY OF TITANIUM HALIDE, HYDROCARBON DILUENT, ETHER, AND ALUMINUM COMPOUND CONOCO INC. (US) 1982-11-09 US claimed
EP-0005618-B1 DEODORANT PRODUCTS, PREPARATION AND USE THEREOF UNILEVER PLC (GB) 1982-06-09 EP claimed
US-4324738-A Dinitriles and their preparation PHILLIPS PETROLEUM COMPANY (US) 1982-04-13 US claimed
US-4299636-A COMPOSITE MODIFIED DOUBLE BASE HERCULES INCORPORATED (US) 1981-11-10 US claimed
US-4294992-A Process for the production of alkyl aryl ethers THE SOUTHLAND CORPORATION (US) 1981-10-13 US claimed
US-4288625-A HYDROGENATION OF DINITRILES; CATALYST COMPRISING PALLADIUM WITH RHODIUM OR RUTHENIUM PHILLIPS PETROLEUM CO. (US) 1981-09-08 US claimed
US-4120866-A REACTING AN AROMATIC COMPOUND WITH A SULFOXIDE BAYER AKTIENGESELLSCHAFT (DE) 1978-10-17 US claimed
US-3961040-A PHOSPHORIC ACID ESTERS, SOLVENTS, ADSORBERS AIRWICK INDUSTRIES, INC. (US) 1976-06-01 US claimed