SCHEMBL775484

SCHEMBL775484

Cc1ccc(C(=O)OC(=O)c2ccccc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.65
CES1 P23141 2/20 0.65
NPC1 O15118 3/20 0.62
RAB9A P51151 3/20 0.62
TDP1 Q9NUW8 1/20 0.59
KMT2A Q03164 2/20 0.59
MEN1 O00255 1/20 0.59
TSHR P16473 1/20 0.56
ALDH1A1 P00352 5/20 0.54
LMNA P02545 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
F2 P00734 1/20 0.54
POLB P06746 1/20 0.53
MAPT P10636 2/20 0.50
AKR1C3 P42330 1/20 0.50
SRD5A2 P31213 1/20 0.48
PTGS2 P35354 1/20 0.47
CYP1B1 Q16678 1/20 0.47
VCP P55072 1/20 0.47
CYP3A4 P08684 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
SCHEMBL28171829 0.98 CES2 (0.63) CES2CES1NPC1RAB9ATDP1
Acetic Acid SCHEMBL776224 0.96 CES2 (0.61) CES2CES1NPC1RAB9ATDP1
Toluene SCHEMBL28319734 0.93 TSHR (0.58) CES2CES1NPC1RAB9ATDP1
SCHEMBL248492 0.91 TDP1 (0.70) CES2CES1NPC1RAB9ATDP1
SCHEMBL6654554 0.91 TDP1 (0.70) CES2CES1NPC1RAB9ATDP1
SCHEMBL18050336 0.90 CES2 (0.59) CES2CES1NPC1RAB9ATDP1
SCHEMBL18050301 0.90 CES2 (0.59) CES2CES1NPC1RAB9ATDP1
SCHEMBL18050275 0.90 CES2 (0.59) CES2CES1NPC1RAB9ATDP1
SCHEMBL18050300 0.90 CES2 (0.59) CES2CES1NPC1RAB9ATDP1
SCHEMBL18050338 0.90 CES2 (0.59) CES2CES1NPC1RAB9ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114031639-B Preparation method of biphospide with P-O-C-P structure 烟台大学 2024-07-12 CN claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-117417363-A Preparation method for synthesizing organic borate compound from anhydride compound 北京理工大学 2024-01-19 CN claimed
CN-116789700-A Compound with visible light response, preparation method and application thereof 北京超精核酸科技有限公司 2023-09-22 CN claimed
CN-114995060-B Negative photosensitive resin composition capable of being cured at low temperature and preparation method and application thereof 明士(北京)新材料开发有限公司 2022-11-01 CN claimed
CN-114995060-A Negative photosensitive resin composition capable of being cured at low temperature and preparation method and application thereof 明士(北京)新材料开发有限公司 2022-09-02 CN claimed
CN-114702651-A Method for preparing polyester material by depolymerization of polytetrahydrofuran-based material and product thereof 浙江大学 2022-07-05 CN claimed
CN-111234070-B Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2022-03-01 CN claimed
CN-114031639-A Preparation method of biphosphonate with P-O-C-P structure 烟台大学 2022-02-11 CN claimed
CN-111234073-B Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2021-12-31 CN claimed
CN-112362791-A HPLC separation method of trifluridine and isomers thereof 国药一心制药有限公司 2021-02-12 CN claimed
EP-3369748-B1 MODIFIED CELLULOSE FINE FIBERS AND METHOD FOR PRODUCING SAME FUTAMURA KAGAKU KK (JP) 2020-07-29 EP claimed
CN-109517207-B Medical polymer material with anti-adhesion and sterilization functional surface and preparation method thereof 中国科学院长春应用化学研究所 2020-06-16 CN claimed
CN-111234070-A Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2020-06-05 CN claimed
CN-111234073-A Catalyst component, catalyst system and prepolymerized catalyst for olefin polymerization, use thereof and olefin polymerization process 中国石油化工股份有限公司 2020-06-05 CN claimed
US-20180273819-A1 THERMAL ENERGY STORAGE PHASE AND TEMPERATURE STABILIZATION CHANGE MATERIALS COMPRISING TRIAMINES AND METHODS FOR MAKING AND USING THEM ENTROPY SOLUTIONS LLC (US) 2018-09-27 US claimed
WO-2016179028-A1 THERMAL ENERGY STORAGE PHASE AND TEMPERATURE STABILIZATION CHANGE MATERIALS AND METHODS FOR MAKING AND USING THEM ENTROPY SOLUTIONS, LLC. (US) 2016-11-10 WO claimed
CN-104262282-B Blue-light semiconductor material containing indeno phenoxazine and preparation method thereof and the organic luminescent device being made up of this material 上海珂力恩特化学材料有限公司 2016-08-24 CN claimed
US-4456565-A BY REACTING ANHYDRIDE WITH ANHYDROUS HYDROCYANIC ACID BAYER AKTIENGESELLSCHAFT (DE) 1984-06-26 US claimed
US-4238412-A CYANATION OF THE ANHYDRIDE BAYER AKTIENGESELLSCHAFT (DE) 1980-12-09 US claimed