SCHEMBL3677313

SCHEMBL3677313

CC(=O)OCc1cccc(C)c1C

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
HSD17B10 Q99714 3/20 0.52
ALDH1A1 P00352 7/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
ESR1 P03372 1/20 0.44
ESR2 Q92731 1/20 0.44
GAA P10253 1/20 0.43
LMNA P02545 1/20 0.42
MAOB P27338 1/20 0.41
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 1/20 0.39
NLRP3 Q96P20 1/20 0.39
HPGD P15428 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
Ammonia Solution, Strong SCHEMBL9355757 0.98 KDM4E (0.51) KDM4EHSD17B10ALDH1A1SMN1; SMN2ESR1
Methyl Alcohol SCHEMBL16597701 0.98 KDM4E (0.51) KDM4EHSD17B10ALDH1A1SMN1; SMN2ESR1
SCHEMBL6552314 0.87 ESR1 (0.45) KDM4EHSD17B10ALDH1A1ESR1ESR2
SCHEMBL1592408 0.87 GAA (0.47) KDM4EHSD17B10ALDH1A1ESR1ESR2
SCHEMBL30417552 0.85 ALDH1A1 (0.57) KDM4EHSD17B10ALDH1A1SMN1; SMN2LMNA
SCHEMBL1984327 0.85 ALDH1A1 (0.57) KDM4EHSD17B10ALDH1A1SMN1; SMN2LMNA
SCHEMBL18230927 0.84 ALDH1A1 (0.47) KDM4EHSD17B10ALDH1A1SMN1; SMN2MAPT
SCHEMBL11064494 0.84 ALDH1A1 (0.47) KDM4EHSD17B10ALDH1A1SMN1; SMN2ESR1
SCHEMBL9818570 0.84 GAA (0.45) KDM4EHSD17B10ALDH1A1ESR1ESR2
SCHEMBL1837900 0.84 ESR1 (0.42) KDM4EHSD17B10ALDH1A1ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117897055-A Method for reducing abnormal odor 奇华顿股份有限公司 2024-04-16 CN claimed
CN-112745984-B Lasting fragrance type essence 广州芬豪香精有限公司 2021-10-22 CN claimed
CN-112745984-A Lasting fragrance type essence 广州芬豪香精有限公司 2021-05-04 CN claimed
US-4582635-A SUSTAINED RELEASE TAKASAGO PERFUMERY CO., LTD. (JP) 1986-04-15 US claimed
CN-117897055-A Method for reducing abnormal odor 奇华顿股份有限公司 2024-04-16 CN disclosed
CN-117462431-A Lemon essence without allergic source and with natural sense 厦门琥珀香精股份有限公司 2024-01-30 CN disclosed
CN-111479549-B Aromatic substance mixture containing 8, 8-dimethyl-6, 10-dioxaspiro [4.5] decane 西姆莱斯有限公司 2023-09-12 CN disclosed
CN-116490598-A Detergent compositions with enhanced efficacy delivery of substances 株式会社LG生活健康 2023-07-25 CN disclosed
CN-115998930-A High-temperature-resistant durable vehicle-mounted perfume and preparation method thereof 广州欧伦奇健康科技有限公司 2023-04-25 CN disclosed
CN-115701977-A Composition for treating hair or fiber comprising alkylketene compound 株式会社LG生活健康 2023-02-14 CN disclosed
CN-115363194-A Grape essence with white grape fragrance and application thereof 广州和泉食品有限公司 2022-11-22 CN disclosed
CN-113265299-B Watermelon essence and electronic atomized liquid containing same 深圳市真味生物科技有限公司 2022-11-11 CN disclosed
EP-1441603-A2 METHOD AND COMPOSITION FOR MENTHOLATION OF CHARCOAL FILTERED CIGARETTES Vector Tobacco Inc. (US) 2004-08-04 EP disclosed
WO-2003041521-A2 METHOD AND COMPOSITION FOR MENTHOLATION OF CHARCOAL FILTERED CIGARETTES VECTOR TOBACCO INC. (US) 2003-05-22 WO disclosed
EP-0907357-A4 NON-AQUEOUS CONTROLLED RELEASE PEST AND AIR CARE GEL COMPOSITION PENNZOIL PROD CO (US) 2001-08-22 EP disclosed
EP-0907357-A1 NON-AQUEOUS CONTROLLED RELEASE PEST AND AIR CARE GEL COMPOSITION PENNZOIL PRODUCTS COMPANY (US) 1999-04-14 EP disclosed
US-5871765-A AIR FRESHENER COMPRISING HYDROCABON, BLEND OF THERMOPLASTIC BLOCK COPOLYMERS, AIR CARE ACTIVE SUBSTANCES PENNZOIL PRODUCTS COMPANY (US) 1999-02-16 US disclosed
WO-1997031623-A1 NON-AQUEOUS CONTROLLED RELEASE PEST AND AIR CARE GEL COMPOSITION PENNZOIL PRODUCTS COMPANY (US) 1997-09-04 WO disclosed
US-4906488-A Modification of permeant ARCADE, INC. (US) 1990-03-06 US disclosed
US-4582635-A SUSTAINED RELEASE TAKASAGO PERFUMERY CO., LTD. (JP) 1986-04-15 US disclosed