SCHEMBL5311432

SCHEMBL5311432

COc1ccc2ccccc2c1.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
SCHEMBL112792 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

Claimed or disclosed in 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3525751-A1 HIGH PERFORMING, HIGH IMPACT BLOOM ACCORD International Flavors & Fragrances Inc. (US) 2019-08-21 EP disclosed
CN-108569957-A 2- naphthyl methyl ethers are extracted from beta naphthal, methanol, 2- naphthyl methyl ethers and p-methyl benzenesulfonic acid and recycle the device and method of component 南京师范大学 2018-09-25 CN disclosed
EP-3365418-A2 PARTICLES FOR MALODOR REDUCTION The Procter and Gamble Company (US) 2018-08-29 EP disclosed
WO-2018071897-A1 HIGH PERFORMING, HIGH IMPACT BLOOM ACCORD INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2018-04-19 WO disclosed
EP-3197423-A1 PRODUCTS COMPRISING MALODOR REDUCTION MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2017-08-02 EP disclosed
EP-3197508-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2017-08-02 EP disclosed
EP-3197426-A1 FRESHENING COMPOSITIONS AND DEVICES COMPRISING SAME THE PROCTER & GAMBLE COMPANY (US) 2017-08-02 EP disclosed
EP-3197511-A1 PERSONAL CARE COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2017-08-02 EP disclosed
EP-3197510-A1 DELIVERY SYSTEMS COMPRISING MALODOR REDUCTION COMPOSITIONS The Procter & Gamble Company (US) 2017-08-02 EP disclosed
EP-3197424-A1 FRESHENING COMPOSITIONS AND DEVICES COMPRISING SAME THE PROCTER & GAMBLE COMPANY (US) 2017-08-02 EP disclosed
WO-2016049455-A1 PERSONAL CARE COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO disclosed
WO-2016049397-A1 FRESHENING COMPOSITIONS AND DEVICES COMPRISING SAME THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO disclosed
WO-2016049395-A1 PRODUCTS COMPRISING MALODOR REDUCTION MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO disclosed
WO-2016049396-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO disclosed
WO-2016049407-A1 ABSORBENT ARTICLE COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO disclosed
WO-2007038524-A2 COCRYSTALLIZATION METHODS SSCI, INC. (US) 2007-04-05 WO disclosed
EP-0991327-B1 MICROORGANISM REDUCTION METHODS AND COMPOSITIONS FOR FOOD CLEANING PROCTER & GAMBLE (US) 2004-12-01 EP disclosed
US-6455086-B1 BASIC FOOD CLEANING COMPOSITIONS USING FOOD COMPATIBLE INGREDIENTS FOR TREATING FOOD SUCH AS PRODUCE, E.G., FRUITS AND VEGETABLES, AND EDIBLE ANIMAL PROTEINS ARE PROVIDED WITH SPECIFIC NON-SUBSTANTIVE PERFUME. LIQUID AND SOLID POWDER THE PROCTER & GAMBLE COMPANY 2002-09-24 US disclosed
EP-0991327-A1 MICROORGANISM REDUCTION METHODS AND COMPOSITIONS FOR FOOD CLEANING THE PROCTER & GAMBLE COMPANY (US) 2000-04-12 EP disclosed
WO-1999000025-A1 MICROORGANISM REDUCTION METHODS AND COMPOSITIONS FOR FOOD CLEANING THE PROCTER & GAMBLE COMPANY (US) 1999-01-07 WO disclosed