SCHEMBL435325

SCHEMBL435325

CC(O)OC(=O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
TP53 P04637 1/20 0.61
PDCD1 Q15116 1/20 0.58
CD274 Q9NZQ7 1/20 0.58
LMNA P02545 4/20 0.54
NPC1 O15118 4/20 0.54
ALDH1A1 P00352 3/20 0.54
RAB9A P51151 3/20 0.54
HTT P42858 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
F2 P00734 1/20 0.54
ADRB2 P07550 1/20 0.49
ADRB1 P08588 1/20 0.49
ADRB3 P13945 1/20 0.49
CA12 O43570 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
CA14 Q9ULX7 1/20 0.48

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
SCHEMBL29626693 1.00 TSHR (0.61) TSHRTP53PDCD1CD274LMNA
Ammonia Solution, Strong SCHEMBL16468685 0.98 TSHR (0.59) TSHRTP53PDCD1CD274LMNA
SCHEMBL319947 0.89 CA1 (0.59) TSHRTP53PDCD1CD274LMNA
SCHEMBL13516938 0.85 TSHR (0.59) TSHRTP53PDCD1CD274LMNA
SCHEMBL7917038 0.85 RAB9A (0.50) TSHRTP53PDCD1CD274LMNA
SCHEMBL902823 0.85 CA1 (0.52) TSHRTP53PDCD1CD274LMNA
SCHEMBL6660758 0.84 TSHR (0.63) TSHRTP53PDCD1CD274LMNA
SCHEMBL10239104 0.84 TSHR (0.63) TSHRTP53PDCD1CD274LMNA
SCHEMBL29311500 0.84 TSHR (0.63) TSHRTP53PDCD1CD274LMNA
SCHEMBL13700339 0.84 TSHR (0.63) TSHRTP53PDCD1CD274LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118356379-A Composition with facial restoration effect, preparation method and application thereof 达尔文新研(北京)生物科技有限公司 2024-07-19 CN claimed
EP-2914233-B1 DENTAL COMPOSITIONS OZDENT PTY LTD (AU) 2021-08-18 EP claimed
US-9861646-B2 Dental compositions OZDENT PTY LTD (AU) 2018-01-09 US claimed
EP-1339760-A4 METHOD FOR PRODUCING HOMO- AND CO-POLYMERS OF ETHYLENE SAMSUNG GENERAL CHEMICALS CO (KR) 2005-01-12 EP claimed
EP-1339760-A1 METHOD FOR PRODUCING HOMO- AND CO-POLYMERS OF ETHYLENE Samsung General Chemicals Co., Ltd. (KR) 2003-09-03 EP claimed
WO-2002038623-A1 METHOD FOR PRODUCING HOMO- AND CO-POLYMERS OF ETHYLENE SAMSUNG GENERAL CHEMICALS CO., LTD. (KR) 2002-05-16 WO claimed
CN-119799678-A PET (polyethylene terephthalate) colipase LCC-D, coding gene, recombinant plasmid, recombinant engineering bacterium and application 加拿大浪潮科技有限公司 2025-04-11 CN disclosed
CN-116410367-A Catalyst system for ethylene polymerization and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN disclosed
CN-116410365-A Polypropylene catalyst and preparation method and application thereof 中国石油天然气股份有限公司 2023-07-11 CN disclosed
CN-113613444-B Shell, preparation method thereof and electronic equipment OPPO广东移动通信有限公司 2022-12-27 CN disclosed
CN-110988190-B HPLC content determination method of marsdenia tenacissima syrup 哈尔滨市康隆药业有限责任公司 2022-09-09 CN disclosed
EP-4003965-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION Nurix Therapeutics, Inc. (US) 2022-06-01 EP disclosed
CN-114051408-A Composition for preventing, ameliorating, or treating cancer 梨花女子大学校产学协力团 2022-02-15 CN disclosed
EP-0602209-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-22 EP disclosed
EP-0382185-B1 Carbostyril derivatives OTSUKA PHARMA CO LTD (JP) 1994-06-15 EP disclosed
WO-1994001113-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1994-01-20 WO disclosed
US-5225402-A Vasopressin antagonist, vasodilation, hypotensive, diuretics and anticoagulants OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-06 US disclosed
US-5118779-A Drug delivery POLYMEDICA INDUSTRIES, INC. (US) 1992-06-02 US disclosed
EP-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed
US-4223160-A NIOBIUM AND RUTHENIUM SALTS AS CATALYSTS UNION CARBIDE CORPORATION (US) 1980-09-16 US disclosed